data_2hfv_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 2hfv _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 ' 1' ' ' MET . . . . . . . . . . . . . 89.0 mtp . . . . . 0 N--CA 1.478 0.968 0 CA-C-O 120.714 0.293 . . . . 72.530000000000001 110.531 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 117.64 90.02 1.42 Allowed Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.821 -0.704 . . . . 61.420000000000002 111.968 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.6 p -66.61 158.08 30.81 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.884 0.374 . . . . 75.530000000000001 110.78 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 m -76.2 97.49 4.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.936 0.398 . . . . 75.319999999999993 110.722 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -90.33 93.64 9.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 65.420000000000002 109.899 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -123.02 99.27 6.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.181 -0.463 . . . . 72.510000000000005 110.11 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 74.9 m-70 -110.49 169.41 8.76 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.067 -0.716 . . . . 73.420000000000002 109.067 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -153.56 130.83 11.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.262 0.554 . . . . 74.310000000000002 111.097 178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -142.99 113.12 7.17 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.445 -0.798 . . . . 71.340000000000003 109.101 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -103.68 112.03 24.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.035 0.445 . . . . 73.310000000000002 110.652 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.1 m -150.65 117.94 6.02 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.714 -0.676 . . . . 71.349999999999994 110.406 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -134.68 88.7 2.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.078 -0.51 . . . . 74.120000000000005 109.928 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -131.67 58.0 0.71 Allowed Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 111.373 -0.691 . . . . 42.109999999999999 111.373 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.89 76.3 8.71 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.638 -0.504 . . . . 71.299999999999997 109.638 -176.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.89 -0.595 . . . . 74.099999999999994 110.736 -177.678 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.7 mt . . . . . 0 C--O 1.231 0.129 0 CA-C-O 121.028 0.442 . . . . 65.209999999999994 111.649 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.876 ' HB2' HD22 ' A' ' 77' ' ' LEU . 50.7 mtt180 -134.4 148.03 50.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.974 -0.557 . . . . 72.439999999999998 109.729 173.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.838 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 25.1 tt0 -81.94 136.58 35.29 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.038 -0.528 . . . . 70.109999999999999 110.701 -177.11 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.668 HD11 HG22 ' A' ' 72' ' ' VAL . 11.2 mp -106.77 -65.86 1.06 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.634 0.254 . . . . 63.329999999999998 111.521 -179.12 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -147.0 177.21 9.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.733 0.301 . . . . 74.140000000000001 110.925 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 28' ' ' ARG . 6.2 ptp180 -148.46 154.28 39.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.319 -0.4 . . . . 73.420000000000002 110.223 -178.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.448 HG23 HD23 ' A' ' 34' ' ' LEU . 12.2 t 178.29 163.61 0.7 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.377 0.423 . . . . 74.239999999999995 110.121 176.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -113.95 -0.17 14.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.009 0.433 . . . . 74.430000000000007 109.834 175.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -73.77 116.51 14.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.755 -0.657 . . . . 72.129999999999995 110.576 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.56 -33.8 74.48 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.55 -0.75 . . . . 63.240000000000002 112.239 -176.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 65.7 t -72.34 -47.53 52.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.818 0.342 . . . . 73.230000000000004 110.25 -178.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.448 HD23 HG23 ' A' ' 29' ' ' THR . 40.2 tp -61.38 -40.83 95.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 75.129999999999995 110.426 178.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.551 HD11 ' HD2' ' A' ' 68' ' ' ARG . 69.9 mt -65.26 -29.17 69.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.959 -0.564 . . . . 73.129999999999995 111.356 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.1 m -76.05 -39.08 56.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.715 0.293 . . . . 62.530000000000001 110.528 177.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.443 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -64.43 -53.89 41.33 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.194 -0.457 . . . . 73.150000000000006 110.935 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.8 t -60.53 -38.25 77.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.066 -0.515 . . . . 63.5 110.884 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.55 -48.39 82.14 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.897 -0.592 . . . . 70.299999999999997 111.918 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.63 -34.66 77.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.714 0.293 . . . . 62.109999999999999 111.629 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 96.2 mt -64.6 -51.48 62.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.14 -0.482 . . . . 75.030000000000001 110.639 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.13 -41.36 74.02 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.93 -0.577 . . . . 74.209999999999994 110.984 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.74 -39.44 91.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.899 -0.591 . . . . 74.120000000000005 110.821 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.0 -25.04 71.95 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.122 -0.561 . . . . 72.319999999999993 112.822 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -102.05 7.98 41.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.542 0.211 . . . . 74.540000000000006 111.412 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.8 t70 61.41 30.55 18.98 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.539 0.685 . . . . 74.140000000000001 110.903 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.578 HG22 ' HB3' ' A' ' 80' ' ' ALA . 72.0 mt -85.13 121.18 36.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.298 -0.41 . . . . 72.439999999999998 110.347 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -62.63 107.98 1.89 Allowed Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.5 -0.64 . . . . 75.049999999999997 111.5 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 72' ' ' VAL . 52.1 p-80 -126.72 166.65 16.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.91 0.386 . . . . 72.200000000000003 111.48 -173.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.5 tp -138.58 104.61 5.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.347 -0.842 . . . . 71.120000000000005 109.676 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.572 HG11 HG23 ' A' ' 70' ' ' VAL . 29.5 m . . . . . 0 C--N 1.323 -0.565 0 CA-C-O 121.506 0.669 . . . . 62.140000000000001 110.141 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo . . . . . 0 N--CA 1.453 -0.874 0 CA-C-O 120.764 0.235 . . . . 71.239999999999995 112.08 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.551 ' HD2' HD11 ' A' ' 35' ' ' LEU . 66.3 mtt180 -104.39 160.61 14.77 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.121 -0.326 . . . . 71.439999999999998 110.121 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.8 ptt180 -133.68 140.8 47.27 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.64 -0.504 . . . . 72.129999999999995 109.64 176.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.572 HG23 HG11 ' A' ' 51' ' ' VAL . 48.5 t -103.63 116.38 47.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.907 -0.588 . . . . 60.0 111.253 -173.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.838 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.4 mp -117.84 162.14 18.59 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.107 -0.701 . . . . 75.019999999999996 109.107 173.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.668 HG22 HD11 ' A' ' 26' ' ' LEU . 35.2 m -137.34 167.41 23.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 120.824 0.345 . . . . 64.319999999999993 110.104 174.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -73.13 137.55 45.24 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.223 -0.658 . . . . 64.219999999999999 109.223 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.798 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 40.9 mt-10 -65.26 -11.15 38.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.657 0.265 . . . . 72.200000000000003 111.584 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -55.59 -39.25 70.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.605 0.717 . . . . 75.200000000000003 110.009 171.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -129.43 33.81 4.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.338 -0.846 . . . . 70.129999999999995 110.215 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.876 HD22 ' HB2' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -56.52 -57.08 13.9 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.656 -0.702 . . . . 74.530000000000001 110.415 -177.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.49 70.36 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.841 -0.618 . . . . 61.25 110.996 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -68.97 -46.77 58.24 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 121.183 -0.532 . . . . 73.140000000000001 112.659 -178.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.578 ' HB3' HG22 ' A' ' 47' ' ' ILE . . . -63.58 -44.4 94.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.739 0.304 . . . . 63.530000000000001 110.862 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 57.2 mtp85 -67.39 -33.32 74.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.443 . . . . 73.230000000000004 110.401 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -62.01 -47.29 85.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.829 -0.623 . . . . 73.329999999999998 109.788 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.5 tp -60.37 -53.19 60.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 75.329999999999998 110.981 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.47 -28.81 68.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.12 -0.491 . . . . 63.100000000000001 112.001 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.737 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 47.4 m -85.26 -48.66 8.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.812 0.339 . . . . 71.349999999999994 111.213 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -74.19 -43.88 55.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.223 -0.444 . . . . 73.329999999999998 111.9 -173.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.54 29.99 4.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.853 0.359 . . . . 64.129999999999995 111.662 -174.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -121.35 -80.0 0.56 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.182 -1.009 . . . . 71.209999999999994 112.306 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.459 HD13 ' N ' ' A' ' 90' ' ' ALA . 1.8 pp -167.58 -44.5 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.873 -0.163 . . . . 75.319999999999993 111.273 -177.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.737 ' HB3' ' HA ' ' A' ' 85' ' ' THR . . . 55.96 94.67 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.724 0.64 . . . . 73.519999999999996 111.704 -178.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -157.64 -64.96 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.523 -0.471 . . . . 72.120000000000005 111.234 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -87.52 16.87 5.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.211 -0.45 . . . . 74.450000000000003 111.824 -172.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 98.8 mt -73.72 126.17 29.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.131 0.491 . . . . 71.530000000000001 111.615 -175.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 115.468 -0.787 . . . . 61.030000000000001 109.152 178.064 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.7 ttp . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 110.176 -0.305 . . . . 74.450000000000003 110.176 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.62 119.24 2.63 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.684 -0.769 . . . . 63.399999999999999 111.993 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.3 t -139.12 97.81 3.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.155 0.502 . . . . 72.25 109.693 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 t -89.78 85.47 6.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.331 -0.618 . . . . 64.239999999999995 109.331 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -131.51 70.77 1.46 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.558 0.694 . . . . 74.420000000000002 110.291 -177.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -125.93 87.54 2.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.641 0.734 . . . . 70.310000000000002 110.828 -178.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.6 p-80 -126.03 37.91 4.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.754 -0.657 . . . . 75.319999999999993 109.848 176.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -70.91 77.94 0.64 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.7 -0.852 . . . . 73.219999999999999 108.7 175.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 37.7 t-80 -122.19 107.85 12.63 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.408 -0.814 . . . . 72.109999999999999 109.694 -173.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -130.28 95.43 3.9 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.561 -0.533 . . . . 73.129999999999995 109.561 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.6 t -129.49 113.97 15.54 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.169 -0.469 . . . . 74.430000000000007 109.775 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.2 t -151.3 112.19 4.27 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.183 -0.462 . . . . 74.219999999999999 110.266 178.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 84.38 65.26 1.53 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.908 -0.663 . . . . 63.43 112.7 177.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.427 ' HD2' ' OD1' ' A' ' 76' ' ' ASP . 51.2 ttp85 -77.25 94.91 4.21 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.869 -0.789 . . . . 75.010000000000005 108.869 177.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 116.214 -0.448 . . . . 72.329999999999998 112.021 -171.445 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.616 HD11 HD21 ' A' ' 50' ' ' LEU . 14.1 mt . . . . . 0 N--CA 1.452 -0.36 0 N-CA-C 110.084 -0.339 . . . . 73.299999999999997 110.084 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.593 ' HB2' HD21 ' A' ' 77' ' ' LEU . 17.5 mmt180 -113.84 133.38 55.45 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.228 -0.442 . . . . 73.439999999999998 110.419 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.673 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 29.6 tt0 -64.83 109.06 1.94 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.721 -0.844 . . . . 71.030000000000001 108.721 175.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.7 tp -87.16 -54.81 4.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.425 -0.352 . . . . 74.099999999999994 110.811 -172.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.58 157.06 43.21 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.282 -0.417 . . . . 73.109999999999999 110.102 177.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.436 ' HG3' ' HB3' ' A' ' 69' ' ' ARG . 39.9 ttp180 -142.73 119.95 11.51 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.628 -0.508 . . . . 72.400000000000006 109.628 179.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -148.91 160.55 43.16 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.107 -0.331 . . . . 64.109999999999999 110.107 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -107.56 10.28 29.26 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.395 -0.366 . . . . 71.349999999999994 110.531 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -92.51 107.51 19.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.382 -0.372 . . . . 72.150000000000006 110.066 177.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.98 -27.15 68.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.953 -0.567 . . . . 72.219999999999999 111.896 -175.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 44.2 t -66.85 -50.91 60.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.861 0.362 . . . . 73.340000000000003 110.477 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.696 HD11 HD23 ' A' ' 89' ' ' LEU . 23.1 tp -64.27 -38.68 91.91 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.979 -0.555 . . . . 63.509999999999998 110.323 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.452 HD11 ' HD2' ' A' ' 68' ' ' ARG . 77.7 mt -61.25 -32.9 72.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.96 -0.564 . . . . 62.039999999999999 111.047 177.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -70.02 -39.27 75.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.905 0.383 . . . . 72.340000000000003 110.559 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.495 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.19 -52.8 52.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 73.129999999999995 110.459 178.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.511 HG11 HD22 ' A' ' 84' ' ' LEU . 86.3 t -60.12 -40.36 83.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.895 -0.593 . . . . 72.010000000000005 110.428 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 43' ' ' ASP . . . -61.7 -49.32 77.56 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.601 -0.727 . . . . 55.299999999999997 112.264 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.37 -31.53 72.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.699 0.285 . . . . 73.400000000000006 111.295 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.679 ' HB3' HD23 ' A' ' 83' ' ' LEU . 94.7 mt -64.61 -51.75 61.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.219 -0.446 . . . . 74.400000000000006 110.702 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.1 mt -71.94 -40.05 68.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.104 -0.498 . . . . 45.420000000000002 110.832 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 39' ' ' GLY . 0.8 OUTLIER -66.5 -35.98 81.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.125 0.488 . . . . 71.219999999999999 110.35 -177.379 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -73.14 -35.51 57.24 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.855 -0.688 . . . . 63.109999999999999 112.378 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.15 -1.0 57.02 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.501 0.185 . . . . 73.340000000000003 111.501 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.4 t70 71.24 28.16 3.07 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.753 0.658 . . . . 55.530000000000001 110.857 177.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -84.02 128.31 38.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.167 -0.47 . . . . 73.439999999999998 110.193 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.81 110.82 3.7 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.064 -0.588 . . . . 65.239999999999995 111.978 -177.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -109.21 130.85 55.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.013 0.435 . . . . 74.140000000000001 111.436 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.616 HD21 HD11 ' A' ' 23' ' ' LEU . 60.8 tp -98.39 102.8 14.65 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.89 -0.782 . . . . 75.439999999999998 108.89 171.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.424 HG11 HG22 ' A' ' 70' ' ' VAL . 6.4 m . . . . . 0 C--N 1.322 -0.613 0 CA-C-N 116.127 -0.488 . . . . 75.099999999999994 110.553 -175.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo . . . . . 0 N--CA 1.46 -0.496 0 N-CA-C 111.092 -0.388 . . . . 70.109999999999999 111.092 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.452 ' HD2' HD11 ' A' ' 35' ' ' LEU . 27.7 ttm180 -66.8 122.69 18.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.036 -0.529 . . . . 75.25 110.289 -177.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.436 ' HB3' ' HG3' ' A' ' 28' ' ' ARG . 19.3 ptt180 -113.27 152.12 30.23 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.727 -0.669 . . . . 75.450000000000003 110.449 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.424 HG22 HG11 ' A' ' 51' ' ' VAL . 29.8 t -112.98 117.51 55.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.683 -0.689 . . . . 74.209999999999994 110.104 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.673 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 7.5 mp -107.86 137.7 45.4 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.013 -0.365 . . . . 71.150000000000006 110.013 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.457 HG22 HD23 ' A' ' 77' ' ' LEU . 14.5 m -132.39 166.07 30.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.143 -0.48 . . . . 71.540000000000006 110.338 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -76.07 156.56 33.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.434 -0.348 . . . . 74.010000000000005 110.451 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.634 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 57.7 mp0 -59.97 -21.89 61.8 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.324 -0.398 . . . . 73.450000000000003 110.908 174.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -52.19 -71.41 0.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.854 -0.612 . . . . 74.400000000000006 110.737 176.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.427 ' OD1' ' HD2' ' A' ' 14' ' ' ARG . 44.5 m-20 -91.38 18.0 7.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.657 -0.701 . . . . 64.329999999999998 110.653 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.634 ' HB2' ' HA ' ' A' ' 74' ' ' GLU . 0.3 OUTLIER -56.87 -51.18 70.07 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.559 -0.534 . . . . 74.400000000000006 109.559 179.242 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.59 -32.48 72.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.602 -0.727 . . . . 62.130000000000003 110.991 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.42 -45.96 43.94 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.069 -0.586 . . . . 74.430000000000007 112.334 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.6 -40.21 95.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.59 0.233 . . . . 62.409999999999997 110.558 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -59.13 -45.03 91.99 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.847 0.356 . . . . 70.040000000000006 110.132 175.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.47 -50.9 72.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.779 -0.646 . . . . 74.099999999999994 110.553 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.679 HD23 ' HB3' ' A' ' 41' ' ' LEU . 55.8 tp -58.61 -52.96 63.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.772 -0.649 . . . . 71.230000000000004 111.257 -177.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.511 HD22 HG11 ' A' ' 38' ' ' VAL . 85.6 mt -66.54 -28.26 68.4 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.226 -0.443 . . . . 74.109999999999999 111.944 -177.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.859 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 90.6 m -82.45 -50.18 9.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.826 0.346 . . . . 64.450000000000003 111.14 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -72.93 -44.13 61.56 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.338 0.495 . . . . 75.310000000000002 112.338 -173.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -121.76 7.26 9.93 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.827 0.677 . . . . 73.209999999999994 112.827 -172.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -111.41 -74.96 0.76 Allowed Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 119.915 -1.136 . . . . 74.150000000000006 112.288 -178.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.696 HD23 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -172.61 -51.89 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.526 0.203 . . . . 74.299999999999997 111.203 -172.357 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.859 ' HB3' ' HA ' ' A' ' 85' ' ' THR . . . 59.2 82.98 0.14 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.905 -0.589 . . . . 54.43 110.74 -172.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -158.79 -44.59 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.03 0.443 . . . . 74.109999999999999 110.796 -176.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -89.91 11.11 21.35 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.071 -0.513 . . . . 71.120000000000005 110.819 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 90.9 mt -71.17 133.0 45.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 63.109999999999999 110.911 -176.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 115.798 -0.637 . . . . 73.510000000000005 110.679 178.659 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.835 0.35 . . . . 53.109999999999999 110.207 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 81.3 -172.4 53.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.751 -0.738 . . . . 52.420000000000002 111.783 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.0 p -141.08 148.28 39.92 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.005 0.402 . . . . 72.439999999999998 110.784 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.2 p -87.0 133.19 33.6 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.041 -0.527 . . . . 71.209999999999994 110.563 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -124.34 116.26 22.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.512 0.672 . . . . 72.519999999999996 111.231 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -145.33 106.57 4.19 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.289 -0.869 . . . . 63.549999999999997 109.715 175.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -127.75 107.25 9.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.488 -0.324 . . . . 73.230000000000004 111.26 -176.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -144.27 146.45 32.64 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.401 -0.592 . . . . 71.010000000000005 109.401 172.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -156.02 118.42 4.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.131 0.491 . . . . 73.450000000000003 111.673 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -145.45 94.17 2.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.74 0.781 . . . . 70.319999999999993 109.923 168.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.1 t -130.65 102.18 6.01 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.356 -0.838 . . . . 64.219999999999999 109.493 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.7 t -149.35 155.34 40.35 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.485 -0.561 . . . . 64.230000000000004 109.485 -176.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 158.97 99.1 0.15 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.909 -0.663 . . . . 74.030000000000001 111.881 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -95.24 -26.91 15.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.917 0.389 . . . . 75.019999999999996 110.487 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 . . . . . 0 C--N 1.327 -0.41 0 CA-C-O 121.222 0.534 . . . . 72.239999999999995 110.326 -179.718 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.5 ' HA ' ' HA ' ' A' ' 73' ' ' HIS . 8.5 mp . . . . . 0 N--CA 1.45 -0.435 0 N-CA-C 109.057 -0.72 . . . . 73.129999999999995 109.057 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -105.3 142.52 34.93 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.407 -0.361 . . . . 73.140000000000001 110.229 -177.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.782 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 28.9 tt0 -76.12 109.07 9.48 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.472 -0.936 . . . . 75.329999999999998 108.472 176.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.82 -70.17 0.56 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.131 -0.486 . . . . 75.400000000000006 112.04 -169.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' ' 92' ' ' GLU . 0.9 OUTLIER -142.38 170.28 15.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.192 0.52 . . . . 74.340000000000003 112.225 -169.645 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.554 ' O ' ' HB3' ' A' ' 92' ' ' GLU . 6.4 ptp180 -138.34 158.04 45.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.881 -1.054 . . . . 73.530000000000001 109.0 177.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.8 t -161.21 163.03 31.4 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.05 -0.352 . . . . 62.32 110.05 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -116.02 11.41 15.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.141 -0.481 . . . . 75.129999999999995 110.363 -174.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -120.41 135.51 55.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.168 -0.469 . . . . 72.109999999999999 111.223 -177.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.21 -31.78 64.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.82 -0.627 . . . . 65.430000000000007 111.522 -176.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.4 t -69.87 -43.43 79.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.621 -0.511 . . . . 71.450000000000003 109.621 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.2 mp -58.84 -48.35 81.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.571 -0.741 . . . . 72.109999999999999 110.846 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.6 mt -52.79 -41.72 64.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.929 -0.578 . . . . 75.299999999999997 111.381 175.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.9 m -72.71 -41.63 65.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.226 -0.443 . . . . 65.409999999999997 111.092 -178.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.481 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -64.05 -54.22 37.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.481 -0.327 . . . . 51.119999999999997 110.649 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.677 HG11 HD23 ' A' ' 84' ' ' LEU . 87.8 t -61.02 -40.46 85.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.147 0.499 . . . . 75.319999999999993 110.607 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.17 -52.04 50.43 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 115.702 -0.681 . . . . 71.019999999999996 112.528 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.33 -31.8 67.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.671 0.272 . . . . 61.219999999999999 111.485 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 94.2 mt -63.15 -51.24 67.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.334 -0.394 . . . . 61.350000000000001 110.341 177.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.4 mt -68.25 -36.8 80.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.836 -0.62 . . . . 73.439999999999998 110.652 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -64.4 -46.84 81.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 72.329999999999998 110.53 177.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.47 -36.97 93.25 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.794 -0.639 . . . . 62.509999999999998 112.93 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.97 -10.72 59.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.012 0.434 . . . . 74.519999999999996 110.81 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.4 t70 70.32 23.71 4.96 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 115.061 -0.972 . . . . 73.340000000000003 110.635 178.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.9 mt -74.32 -39.34 48.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.701 -0.682 . . . . 71.140000000000001 109.485 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.19 110.68 0.33 Allowed Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 114.928 -1.033 . . . . 70.209999999999994 112.077 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -91.71 150.79 20.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.826 0.346 . . . . 63.020000000000003 110.884 -177.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.4 tp -114.09 87.31 2.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.785 -0.82 . . . . 71.129999999999995 108.785 170.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.679 HG13 HG23 ' A' ' 70' ' ' VAL . 6.3 m . . . . . 0 C--N 1.323 -0.549 0 CA-C-O 121.521 0.677 . . . . 62.009999999999998 110.892 -176.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo . . . . . 0 C--O 1.234 0.321 0 CA-C-O 120.793 0.247 . . . . 74.400000000000006 111.854 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -69.0 139.81 55.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.321 -0.4 . . . . 74.230000000000004 110.222 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 63.2 mtt180 -114.1 155.22 26.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.198 -0.455 . . . . 74.299999999999997 110.275 -176.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.679 HG23 HG13 ' A' ' 51' ' ' VAL . 31.6 t -113.02 120.83 64.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.254 -0.43 . . . . 72.420000000000002 110.356 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.782 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.8 mp -114.89 143.52 45.0 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.609 0.242 . . . . 75.430000000000007 110.826 177.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.0 m -142.35 160.84 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 116.179 -0.464 . . . . 74.230000000000004 110.112 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 23' ' ' LEU . 2.0 p-80 -72.48 143.3 48.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.149 0.499 . . . . 74.310000000000002 111.255 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.857 ' HA ' HD23 ' A' ' 77' ' ' LEU . 31.1 tt0 -57.1 -37.01 71.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.056 -0.974 . . . . 63.229999999999997 113.059 -169.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -64.17 -18.95 64.96 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.33 0.492 . . . . 63.020000000000003 112.33 -171.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -117.12 15.22 15.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.019 0.438 . . . . 73.299999999999997 110.869 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.857 HD23 ' HA ' ' A' ' 74' ' ' GLU . 0.6 OUTLIER -58.96 -41.12 86.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.744 -0.662 . . . . 54.43 110.451 177.383 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.07 -40.33 80.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.913 -0.585 . . . . 75.219999999999999 111.187 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.91 -47.3 25.73 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.58 -0.819 . . . . 75.129999999999995 112.268 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.448 ' O ' ' HG ' ' A' ' 84' ' ' LEU . . . -63.07 -41.82 99.53 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.717 0.266 . . . . 65.549999999999997 111.717 -177.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -58.84 -47.75 83.76 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 120.574 0.226 . . . . 75.510000000000005 110.887 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -56.52 -45.15 81.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.2 0.524 . . . . 75.209999999999994 110.372 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 45.1 tp -64.9 -52.04 58.64 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.474 -0.785 . . . . 74.430000000000007 111.256 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.677 HD23 HG11 ' A' ' 38' ' ' VAL . 76.2 mt -70.41 -28.05 64.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.114 -0.494 . . . . 73.450000000000003 111.883 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.868 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.8 m -75.5 -49.49 18.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.645 0.26 . . . . 54.140000000000001 110.755 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -75.34 -44.15 46.81 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.042 0.386 . . . . 73.430000000000007 112.042 -174.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -115.04 20.15 15.24 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.152 0.427 . . . . 73.340000000000003 112.152 -173.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -125.84 -80.51 0.38 Allowed Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 120.176 -1.011 . . . . 73.219999999999999 111.527 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.626 HD12 ' N ' ' A' ' 90' ' ' ALA . 0.9 OUTLIER 176.77 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.763 0.425 . . . . 73.340000000000003 111.302 -176.827 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.868 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 65.12 7.05 3.83 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.165 0.802 . . . . 75.129999999999995 113.165 177.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -85.49 -33.95 21.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.923 0.392 . . . . 64.400000000000006 110.941 -177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.554 ' HB3' ' O ' ' A' ' 28' ' ' ARG . 5.7 mm-40 -80.85 1.17 31.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.716 -0.674 . . . . 75.219999999999999 111.161 -174.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 83.7 mt -66.6 115.37 6.38 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.232 -0.44 . . . . 65.540000000000006 111.62 -174.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 . . . . . 0 N--CA 1.463 0.219 0 CA-C-N 114.916 -1.038 . . . . 75.349999999999994 111.879 177.826 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 120.768 0.318 . . . . 70.120000000000005 110.46 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.12 113.89 0.31 Allowed Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.028 -0.606 . . . . 43.439999999999998 111.824 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.4 m -108.18 152.75 24.15 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.418 -0.586 . . . . 71.109999999999999 109.418 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.5 m -77.08 85.93 3.57 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.183 0.516 . . . . 64.120000000000005 110.103 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -89.43 73.42 7.89 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.668 0.747 . . . . 73.230000000000004 110.022 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -145.72 145.16 30.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.262 -0.881 . . . . 75.540000000000006 109.792 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -131.04 114.92 15.78 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.975 -0.557 . . . . 63.450000000000003 109.837 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -79.14 144.73 34.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.863 0.363 . . . . 74.120000000000005 110.527 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -159.53 122.58 3.6 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.459 -0.571 . . . . 75.040000000000006 109.459 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -117.67 114.31 23.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.078 0.466 . . . . 75.109999999999999 110.361 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.9 m -152.52 85.8 1.26 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.616 -0.72 . . . . 72.430000000000007 109.676 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.9 t -162.81 150.85 13.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.768 -0.651 . . . . 50.439999999999998 109.56 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 149.66 149.99 5.14 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.821 -0.704 . . . . 64.030000000000001 112.11 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 70.1 mtp180 -134.92 -175.52 3.93 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.626 0.25 . . . . 75.439999999999998 110.334 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 . . . . . 0 C--N 1.323 -0.573 0 CA-C-N 116.029 -0.532 . . . . 64.340000000000003 109.944 175.823 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.548 ' HG ' ' HD2' ' A' ' 73' ' ' HIS . 5.1 mp . . . . . 0 N--CA 1.454 -0.229 0 CA-C-O 120.688 0.28 . . . . 75.230000000000004 110.285 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.443 ' HB2' HD22 ' A' ' 77' ' ' LEU . 28.4 mmm-85 -133.35 133.84 43.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.039 -0.528 . . . . 74.310000000000002 110.149 -176.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.558 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 71.8 tt0 -68.59 114.74 7.24 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.529 -0.545 . . . . 74.150000000000006 109.529 173.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.491 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -84.72 -54.7 4.53 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.705 -0.48 . . . . 74.319999999999993 109.705 -175.89 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.555 HD12 HG21 ' A' ' 38' ' ' VAL . 2.1 pt? -148.27 160.7 42.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.149 0.5 . . . . 64.030000000000001 110.956 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.493 ' HG3' ' HG2' ' A' ' 69' ' ' ARG . 51.6 ttt180 -141.23 122.7 15.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.469 -0.787 . . . . 74.340000000000003 109.58 -178.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 t -150.26 177.81 9.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.675 0.274 . . . . 74.530000000000001 110.296 -177.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -124.67 -4.03 7.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.126 -0.488 . . . . 71.519999999999996 110.903 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -85.49 125.12 32.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.939 0.4 . . . . 75.219999999999999 110.769 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.6 -41.07 80.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.628 -0.715 . . . . 74.549999999999997 111.677 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.2 t -63.36 -43.26 98.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-O 121.277 0.561 . . . . 73.329999999999998 110.819 -176.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.514 ' CD2' ' HG3' ' A' ' 92' ' ' GLU . 47.6 tp -62.3 -44.46 96.47 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.791 -0.64 . . . . 54.119999999999997 110.798 178.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 68.2 mt -59.41 -39.56 83.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 75.150000000000006 111.266 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.7 m -62.47 -38.72 90.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.837 0.351 . . . . 70.230000000000004 110.958 178.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.444 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -66.83 -48.72 68.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 71.239999999999995 110.634 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.555 HG21 HD12 ' A' ' 27' ' ' LEU . 60.4 t -61.32 -39.92 84.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.971 -0.559 . . . . 72.420000000000002 110.6 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.64 -45.59 95.4 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.109 -0.567 . . . . 64.420000000000002 112.46 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.63 -28.98 69.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.904 0.383 . . . . 75.140000000000001 111.388 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 93.3 mt -73.6 -51.47 16.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.141 -0.481 . . . . 63.049999999999997 110.333 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.0 mt -66.66 -39.36 88.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.784 -0.644 . . . . 70.530000000000001 111.11 -176.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -70.18 -36.87 74.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.779 0.323 . . . . 72.310000000000002 110.784 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.45 -32.26 78.7 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.689 -0.767 . . . . 73.450000000000003 112.526 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.409 ' HB2' HG13 ' A' ' 47' ' ' ILE . . . -93.06 11.78 26.43 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.504 0.192 . . . . 72.040000000000006 111.466 -178.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.7 t70 59.26 30.15 19.84 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 122.016 0.912 . . . . 71.329999999999998 110.812 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.409 HG13 ' HB2' ' A' ' 45' ' ' ALA . 60.3 mt -83.97 -44.7 18.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.685 -0.688 . . . . 72.010000000000005 109.791 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.1 139.34 5.85 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.036 -0.983 . . . . 71.349999999999994 111.253 -175.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -123.75 117.14 24.26 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.101 0.477 . . . . 71.120000000000005 110.628 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.8 mt -101.71 96.51 7.14 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.781 -0.451 . . . . 74.319999999999993 109.781 176.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.696 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 30.6 m . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.097 -0.501 . . . . 64.540000000000006 110.228 178.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo . . . . . 0 N--CA 1.459 -0.514 0 CA-C-O 120.983 0.326 . . . . 75.329999999999998 111.941 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -87.72 133.43 33.85 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.563 -0.532 . . . . 70.099999999999994 109.563 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.696 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 60.1 mtp180 -120.03 137.94 53.8 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.779 -0.646 . . . . 70.439999999999998 109.722 -169.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.65 HG22 HG13 ' A' ' 51' ' ' VAL . 8.1 t -99.95 105.94 18.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.823 0.344 . . . . 74.209999999999994 110.728 -171.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.558 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 9.1 mp -104.2 127.7 51.84 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.126 -0.488 . . . . 60.32 110.58 177.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 29.7 m -109.56 -176.04 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.602 -0.726 . . . . 72.239999999999995 109.648 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.548 ' HD2' ' HG ' ' A' ' 23' ' ' LEU . 43.1 m80 -107.22 162.37 13.94 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.938 -0.305 . . . . 63.140000000000001 110.267 -179.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -59.48 -22.73 62.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.407 0.622 . . . . 75.200000000000003 109.978 173.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -50.25 -36.18 30.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.477 -1.238 . . . . 51.420000000000002 112.684 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -141.49 30.59 1.72 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.853 0.358 . . . . 72.109999999999999 110.605 -175.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.443 HD22 ' HB2' ' A' ' 24' ' ' ARG . 0.2 OUTLIER -57.95 -47.4 83.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.05 0.453 . . . . 65.5 110.593 -177.081 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.29 -40.49 74.23 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.003 -0.544 . . . . 74.049999999999997 111.129 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -66.39 -48.21 65.19 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.903 -0.665 . . . . 74.239999999999995 112.157 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.71 -41.2 77.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.764 0.316 . . . . 71.450000000000003 110.815 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -59.12 -53.98 52.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.353 -0.385 . . . . 72.239999999999995 111.078 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -64.73 -38.21 90.2 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 121.175 -0.21 . . . . 71.409999999999997 111.265 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.3 tp -58.69 -47.98 82.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.077 0.465 . . . . 72.239999999999995 110.708 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.56 ' HG ' HD11 ' A' ' 89' ' ' LEU . 11.1 mp -72.89 -28.67 62.62 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.056 -0.52 . . . . 73.400000000000006 111.213 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.686 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 89.5 m -66.36 -46.14 77.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 110.358 -0.238 . . . . 43.43 110.358 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.62 -31.74 72.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.274 -0.421 . . . . 73.409999999999997 110.72 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.96 -27.06 67.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.067 0.461 . . . . 32.450000000000003 111.115 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.73 -15.83 59.27 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.801 -0.714 . . . . 73.109999999999999 112.493 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.56 HD11 ' HG ' ' A' ' 84' ' ' LEU . 3.2 pp -84.55 9.42 13.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.766 0.317 . . . . 73.200000000000003 111.366 -177.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.686 ' HB3' ' HA ' ' A' ' 85' ' ' THR . . . -65.65 86.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.131 0.491 . . . . 65.230000000000004 110.039 174.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -163.77 -37.23 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.4 -0.818 . . . . 71.109999999999999 110.009 -177.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.514 ' HG3' ' CD2' ' A' ' 34' ' ' LEU . 20.8 mm-40 -80.44 4.13 19.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.319 -0.401 . . . . 62.119999999999997 110.91 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.445 HD11 ' HA ' ' A' ' 90' ' ' ALA . 10.2 mp -65.61 142.85 57.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.058 -0.519 . . . . 72.310000000000002 111.16 -177.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? . . . . . 0 C--N 1.32 -0.688 0 CA-C-N 115.935 -0.575 . . . . 73.439999999999998 110.008 177.578 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 120.979 0.418 . . . . 74.409999999999997 110.34 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -119.74 42.47 1.75 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.444 -0.884 . . . . 60.530000000000001 112.107 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.0 m -140.19 91.17 2.43 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.068 0.461 . . . . 73.530000000000001 109.81 178.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 m -129.04 93.63 3.64 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.825 -0.625 . . . . 73.310000000000002 110.607 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -133.56 88.36 2.47 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.128 -0.487 . . . . 71.129999999999995 111.09 176.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -113.59 118.47 34.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.759 -0.655 . . . . 71.439999999999998 109.477 173.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -158.77 113.16 2.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.258 -0.428 . . . . 75.319999999999993 110.201 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -141.52 127.05 18.9 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.778 -0.647 . . . . 71.150000000000006 109.847 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -170.74 82.79 0.09 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.208 -0.451 . . . . 62.219999999999999 110.036 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -150.87 93.2 1.91 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.394 -0.366 . . . . 60.229999999999997 111.029 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.2 m -156.59 94.65 1.49 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.974 -0.557 . . . . 74.549999999999997 109.593 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.0 m -148.0 126.8 12.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.809 0.299 . . . . 70.230000000000004 111.809 -177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 92.69 130.4 5.31 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.119 -0.562 . . . . 62.009999999999998 114.189 170.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.72 157.27 37.8 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.231 -0.655 . . . . 74.150000000000006 109.231 170.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 C--N 1.321 -0.633 0 CA-C-O 121.072 0.463 . . . . 70.340000000000003 111.386 179.73 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.4 ' HG ' ' HA ' ' A' ' 73' ' ' HIS . 6.5 mp . . . . . 0 C--O 1.23 0.071 0 N-CA-C 109.83 -0.433 . . . . 72.340000000000003 109.83 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -115.71 148.74 39.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.622 0.249 . . . . 73.5 111.263 -176.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.932 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.8 tt0 -84.13 121.4 27.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.957 -0.565 . . . . 62.420000000000002 110.51 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.429 ' CD1' HG23 ' A' ' 72' ' ' VAL . 9.8 mp -100.6 -66.21 0.92 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.803 0.668 . . . . 75.420000000000002 112.803 -173.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.604 ' CB ' ' HA ' ' A' ' 93' ' ' LEU . 2.4 pt? -142.25 169.22 18.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.18 0.514 . . . . 73.019999999999996 111.934 -171.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -100.87 136.19 41.11 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.089 -0.96 . . . . 73.010000000000005 109.443 176.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.8 p -117.74 92.32 3.81 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.539 0.685 . . . . 70.430000000000007 111.172 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.418 ' H ' HD21 ' A' ' 30' ' ' ASN . 0.1 OUTLIER -111.54 9.53 21.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.817 0.818 . . . . 74.0 109.352 175.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.464 ' HB3' ' HB3' ' A' ' 34' ' ' LEU . 18.1 t70 -114.03 125.53 54.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.83 -1.077 . . . . 64.310000000000002 109.799 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.24 -44.02 97.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.19 -0.459 . . . . 73.439999999999998 111.602 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 46.9 t -70.76 -44.58 76.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.309 -0.405 . . . . 62.32 110.668 -176.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' A' ' 92' ' ' GLU . 29.2 tp -58.65 -42.74 89.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.969 -0.56 . . . . 71.209999999999994 111.204 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 64.8 tp -62.49 -35.79 80.48 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.176 -0.465 . . . . 62.439999999999998 110.875 -177.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.2 m -70.55 -42.38 71.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 54.240000000000002 110.648 176.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.425 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.72 -54.1 31.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 63.229999999999997 111.537 -177.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.483 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 87.1 t -62.7 -41.07 90.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.997 0.427 . . . . 64.340000000000003 110.662 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.36 -34.33 89.62 Favored Glycine 0 N--CA 1.453 -0.196 0 CA-C-N 115.784 -0.644 . . . . 64.420000000000002 112.489 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.57 -36.28 68.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 55.520000000000003 110.779 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 87.2 mt -65.74 -46.3 79.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.996 -0.547 . . . . 73.409999999999997 110.501 178.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 38' ' ' VAL . 85.7 mt -59.02 -47.77 84.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.577 -0.738 . . . . 64.349999999999994 110.559 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -68.56 -37.51 79.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.131 -0.486 . . . . 75.019999999999996 110.856 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.1 -20.76 67.36 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 115.788 -0.642 . . . . 55.420000000000002 113.182 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.405 ' HB3' HG13 ' A' ' 47' ' ' ILE . . . -109.68 7.97 24.6 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.802 -0.234 . . . . 75.430000000000007 111.218 179.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.7 t70 61.07 33.99 19.33 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.748 0.785 . . . . 72.239999999999995 110.665 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.913 HG21 ' HB3' ' A' ' 76' ' ' ASP . 84.8 mt -82.41 120.25 33.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.521 -0.763 . . . . 63.310000000000002 110.321 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.68 109.45 2.91 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.927 -0.654 . . . . 71.420000000000002 111.747 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -126.39 148.14 49.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.976 0.417 . . . . 72.310000000000002 111.065 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 65.5 tp -127.99 127.98 44.2 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.774 -0.648 . . . . 73.129999999999995 109.579 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.3 m . . . . . 0 C--N 1.318 -0.769 0 CA-C-O 120.989 0.423 . . . . 74.219999999999999 110.948 179.84 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo . . . . . 0 N--CA 1.461 -0.385 0 CA-C-O 120.465 0.111 . . . . 44.020000000000003 111.813 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 -58.96 136.89 58.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.505 -0.554 . . . . 72.219999999999999 109.505 175.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -113.35 139.45 48.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.853 0.358 . . . . 74.420000000000002 110.905 -175.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.4 t -105.38 118.49 52.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.02 -0.536 . . . . 62.119999999999997 110.68 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.932 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.9 mp -114.96 150.23 36.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.843 -0.617 . . . . 71.439999999999998 109.771 177.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.802 HG22 HD21 ' A' ' 77' ' ' LEU . 34.4 m -130.56 163.3 36.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.295 0.569 . . . . 72.019999999999996 111.233 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.44 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 41.2 t-80 -75.87 150.89 37.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.274 -0.875 . . . . 73.319999999999993 110.841 -176.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 24.4 mm-40 -38.74 -64.72 0.42 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.148 1.166 . . . . 73.030000000000001 114.148 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -67.38 -19.09 65.36 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.442 0.639 . . . . 72.430000000000007 110.963 -174.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.913 ' HB3' HG21 ' A' ' 47' ' ' ILE . 2.4 m-20 -85.73 -14.06 46.47 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.343 -0.844 . . . . 71.420000000000002 110.613 -176.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.802 HD21 HG22 ' A' ' 72' ' ' VAL . 1.6 mm? -52.72 -57.94 8.47 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.095 -0.502 . . . . 74.099999999999994 111.409 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.56 -42.88 83.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.996 -0.547 . . . . 55.140000000000001 111.056 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.42 -48.11 77.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.813 -0.708 . . . . 54.030000000000001 112.555 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.469 ' HB3' HG23 ' A' ' 47' ' ' ILE . . . -65.47 -47.31 76.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.648 0.261 . . . . 75.230000000000004 111.417 -178.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.515 ' HD2' HD12 ' A' ' 77' ' ' LEU . 39.3 mtp180 -64.44 -38.83 92.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.402 -0.363 . . . . 72.310000000000002 110.582 -177.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 82' ' ' ARG . 40.9 ttt-85 -66.42 -44.33 83.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.116 0.484 . . . . 71.420000000000002 110.389 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.4 tp -62.31 -47.52 83.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.586 -0.733 . . . . 74.409999999999997 111.283 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.87 -28.72 70.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 63.299999999999997 110.962 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.9 m -74.46 -39.15 62.7 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.827 0.346 . . . . 75.200000000000003 110.505 177.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -66.49 -37.02 84.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.024 0.44 . . . . 73.340000000000003 110.688 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.26 -17.27 52.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.971 -0.559 . . . . 74.310000000000002 111.172 178.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 78.16 28.54 55.92 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.863 -0.608 . . . . 73.200000000000003 112.796 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.8 mt -103.56 5.09 36.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.977 0.418 . . . . 74.019999999999996 110.639 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.795 ' HA ' HD12 ' A' ' 93' ' ' LEU . . . -76.22 73.03 3.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.297 0.57 . . . . 64.310000000000002 110.681 178.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -129.31 -34.24 1.86 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.759 -0.655 . . . . 63.140000000000001 110.407 179.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.57 ' HG3' HD22 ' A' ' 34' ' ' LEU . 51.7 mm-40 -98.18 8.7 44.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.582 -0.735 . . . . 75.019999999999996 111.011 -175.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.795 HD12 ' HA ' ' A' ' 90' ' ' ALA . 7.8 mp -80.99 121.34 25.92 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.822 -0.436 . . . . 65.400000000000006 109.822 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 . . . . . 0 N--CA 1.452 -0.343 0 CA-C-O 121.51 0.671 . . . . 65.019999999999996 110.327 -177.997 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.4 ttp . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.802 0.335 . . . . 74.140000000000001 110.247 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.12 60.14 0.92 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.518 -0.849 . . . . 72.099999999999994 112.505 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 10.7 m -77.78 99.77 6.02 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.465 -0.568 . . . . 73.319999999999993 109.465 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.9 t -129.9 101.34 5.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.459 -0.337 . . . . 63.229999999999997 110.942 -174.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -82.76 132.3 35.18 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.624 -0.51 . . . . 64.430000000000007 109.624 176.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -98.9 122.82 42.65 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.253 0.549 . . . . 72.420000000000002 111.565 -173.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.0 p-80 -133.23 115.44 14.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.374 -0.83 . . . . 75.510000000000005 109.171 175.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 18.8 t-80 -138.28 -15.9 1.25 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.284 -0.416 . . . . 72.430000000000007 110.737 -176.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -76.61 77.07 3.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.184 0.516 . . . . 72.239999999999995 110.314 177.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -93.5 -33.6 13.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.62 -0.718 . . . . 75.140000000000001 109.646 178.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -82.65 114.1 20.79 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.516 -0.766 . . . . 71.510000000000005 110.066 177.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.0 t -140.22 107.65 5.56 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.991 -0.549 . . . . 70.099999999999994 110.482 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 107.2 146.99 13.41 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 111.325 -0.71 . . . . 53.140000000000001 111.325 -176.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.5 ptp85 -143.18 -14.65 0.69 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.141 0.47 . . . . 71.230000000000004 111.931 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 C--N 1.328 -0.366 0 CA-C-O 121.801 0.81 . . . . 75.400000000000006 110.803 -177.543 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.0 mp . . . . . 0 N--CA 1.47 0.526 0 CA-C-O 121.728 0.775 . . . . 64.200000000000003 112.479 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -117.17 155.24 29.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.018 -0.992 . . . . 71.150000000000006 109.442 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.843 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 37.5 tt0 -85.09 121.87 28.49 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.844 -0.799 . . . . 75.219999999999999 108.844 171.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.415 ' O ' ' HA ' ' A' ' 93' ' ' LEU . 10.9 mp -87.42 -66.53 0.9 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.359 -0.382 . . . . 74.329999999999998 111.433 -176.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.513 HD21 HG12 ' A' ' 38' ' ' VAL . 4.0 pp -143.02 160.83 39.63 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.718 -0.393 . . . . 75.420000000000002 111.041 -175.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -144.07 129.18 18.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.513 -0.767 . . . . 74.299999999999997 109.385 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.2 t -151.49 163.46 38.96 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.964 0.411 . . . . 73.129999999999995 110.814 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -110.69 0.59 17.51 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.803 -0.635 . . . . 64.040000000000006 110.758 -177.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -94.43 123.55 37.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.892 0.377 . . . . 75.109999999999999 110.768 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.26 -27.77 63.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 61.200000000000003 111.75 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.28 -50.53 72.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.954 0.407 . . . . 71.319999999999993 110.284 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.7 tp -62.4 -40.19 95.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.067 -0.515 . . . . 74.420000000000002 110.47 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.504 HD23 ' HD2' ' A' ' 68' ' ' ARG . 76.7 mt -62.15 -31.28 71.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.859 -0.61 . . . . 73.409999999999997 111.351 177.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.0 m -75.6 -44.84 40.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.792 0.33 . . . . 75.219999999999999 110.501 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.475 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -59.94 -50.5 73.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 64.340000000000003 111.055 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.513 HG12 HD21 ' A' ' 27' ' ' LEU . 95.8 t -69.84 -41.93 79.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-O 121.104 0.478 . . . . 72.420000000000002 110.448 178.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.62 -49.13 81.83 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.742 -0.663 . . . . 53.340000000000003 112.793 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.43 -26.41 67.85 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.704 0.261 . . . . 65.549999999999997 111.704 -177.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.56 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.6 mt -69.9 -52.25 26.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.018 0.437 . . . . 73.219999999999999 110.616 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.3 mt -74.5 -39.58 62.35 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.015 -0.538 . . . . 74.540000000000006 111.067 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -68.61 -42.4 78.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.998 -0.546 . . . . 74.129999999999995 110.794 -177.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.96 -29.31 67.18 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 121.12 -0.562 . . . . 51.530000000000001 112.737 -177.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -85.74 -0.75 56.08 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.68 -0.306 . . . . 74.510000000000005 111.184 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.7 t70 66.82 21.23 10.51 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.611 0.72 . . . . 74.349999999999994 110.941 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 63.6 mt -75.84 142.83 13.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.699 -0.682 . . . . 73.5 109.528 177.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.52 113.44 4.91 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.963 -0.637 . . . . 61.329999999999998 111.832 177.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 33.6 p-80 -128.3 99.3 5.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.328 0.585 . . . . 60.409999999999997 111.532 -173.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.6 tp -83.21 89.0 6.91 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.839 -0.619 . . . . 70.540000000000006 109.373 176.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.655 HG12 HG22 ' A' ' 70' ' ' VAL . 14.9 m . . . . . 0 C--N 1.323 -0.587 0 CA-C-N 115.592 -0.731 . . . . 72.439999999999998 110.502 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo . . . . . 0 N--CA 1.445 -1.378 0 CA-C-O 120.71 0.212 . . . . 60.340000000000003 112.143 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.504 ' HD2' HD23 ' A' ' 35' ' ' LEU . 42.2 ttm180 -74.01 132.66 42.6 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.391 -0.596 . . . . 74.140000000000001 109.391 177.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -113.02 134.49 54.49 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.883 -0.599 . . . . 75.019999999999996 109.514 -174.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.655 HG22 HG12 ' A' ' 51' ' ' VAL . 42.5 t -112.85 118.63 58.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.097 -0.501 . . . . 73.219999999999999 110.8 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.843 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.1 mp -122.71 143.03 50.07 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.136 -0.484 . . . . 74.25 110.058 177.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.5 HG22 HD22 ' A' ' 77' ' ' LEU . 33.0 m -133.56 169.91 20.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.728 -0.215 . . . . 71.010000000000005 110.59 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -74.01 142.19 45.78 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.184 -0.673 . . . . 74.200000000000003 109.184 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.742 ' HA ' HD21 ' A' ' 77' ' ' LEU . 40.3 mt-10 -73.57 -8.46 56.06 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.198 0.814 . . . . 71.349999999999994 113.198 -171.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -86.31 -23.69 26.17 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.204 0.526 . . . . 73.420000000000002 109.77 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -101.18 8.65 42.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.745 -0.661 . . . . 73.549999999999997 110.132 172.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.742 HD21 ' HA ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -59.05 -55.39 35.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.823 -0.626 . . . . 72.439999999999998 110.115 -178.291 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.38 -36.32 71.11 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.129 -0.487 . . . . 64.409999999999997 111.12 177.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.37 -49.14 72.67 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.982 -0.628 . . . . 74.530000000000001 112.007 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.05 -42.94 93.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.502 0.192 . . . . 75.040000000000006 111.108 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.639 ' HD2' HD12 ' A' ' 77' ' ' LEU . 74.8 mtp180 -58.64 -47.25 85.05 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.507 -0.315 . . . . 74.140000000000001 110.412 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -58.72 -47.26 85.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 75.340000000000003 110.304 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.56 HD21 ' HB3' ' A' ' 41' ' ' LEU . 46.8 tp -60.94 -49.61 76.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.729 -0.669 . . . . 75.209999999999994 111.101 -178.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.485 HD22 HG13 ' A' ' 38' ' ' VAL . 84.5 mt -64.93 -36.77 85.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.471 -0.331 . . . . 75.109999999999999 111.351 -178.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 33.2 m -70.99 -41.76 70.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.899 0.38 . . . . 72.310000000000002 110.404 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -65.98 -34.51 78.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.939 -0.573 . . . . 64.540000000000006 110.694 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.54 -34.29 60.73 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.932 -0.576 . . . . 70.319999999999993 111.195 177.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 98.96 28.64 7.66 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.807 -0.711 . . . . 75.049999999999997 111.916 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 97.4 mt -113.79 -1.9 13.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.154 0.502 . . . . 74.040000000000006 110.897 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.571 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -75.0 93.61 2.74 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.547 . . . . 54.340000000000003 110.024 177.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -155.13 -44.71 0.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.96 -0.564 . . . . 75.120000000000005 110.346 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -84.27 10.6 10.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.097 -0.501 . . . . 65.5 111.209 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.571 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.3 mp -77.79 101.08 6.55 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.191 -0.459 . . . . 64.200000000000003 109.764 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.434 ' HD2' ' HA ' ' A' ' 94' ' ' ARG . 15.2 tpt180 . . . . . 0 C--N 1.322 -0.614 0 CA-C-N 116.245 -0.434 . . . . 74.209999999999994 110.494 -175.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.9 tpt . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.637 0.256 . . . . 74.239999999999995 110.711 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.2 -6.56 0.15 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.018 -1.087 . . . . 74.450000000000003 113.177 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.1 p -76.39 100.42 5.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.194 0.521 . . . . 63.219999999999999 110.867 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.6 m -152.01 -171.17 3.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.921 -0.581 . . . . 74.540000000000006 109.682 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.6 t60 75.06 -36.0 0.3 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.077 0.551 . . . . 72.340000000000003 111.756 177.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -77.12 86.62 3.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.447 0.641 . . . . 75.540000000000006 109.887 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -135.96 121.95 20.07 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.495 -0.775 . . . . 73.230000000000004 109.202 -177.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -152.29 155.09 37.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.752 -0.203 . . . . 73.129999999999995 110.869 -177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -159.92 106.5 1.62 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.966 0.413 . . . . 73.409999999999997 110.292 176.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.7 t-80 -139.34 80.85 1.8 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.884 -0.598 . . . . 73.319999999999993 109.988 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.7 p -98.68 91.36 5.08 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.006 -0.543 . . . . 63.140000000000001 110.687 -178.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.1 p -132.58 110.89 10.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.046 -0.525 . . . . 63.240000000000002 111.095 -177.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 135.15 131.65 3.08 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.476 -0.869 . . . . 61.009999999999998 112.354 178.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -118.49 -37.38 3.32 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.8 0.333 . . . . 74.129999999999995 110.525 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 121.4 0.619 . . . . 64.230000000000004 110.682 -179.612 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.596 HD21 ' HB2' ' A' ' 50' ' ' LEU . 8.6 mp . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 121.144 0.497 . . . . 72.109999999999999 111.515 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 50.7 mtm180 -110.35 145.39 37.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.288 -0.415 . . . . 70.420000000000002 111.348 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.534 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 32.1 tt0 -70.88 110.96 5.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.651 -0.704 . . . . 70.040000000000006 109.877 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.482 HD22 HG21 ' A' ' 72' ' ' VAL . 57.0 tp -98.85 -38.23 9.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.211 -0.45 . . . . 54.240000000000002 111.348 -174.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.592 ' HG ' ' HB ' ' A' ' 70' ' ' VAL . 1.0 OUTLIER -142.55 148.8 38.16 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.259 0.552 . . . . 74.400000000000006 110.805 179.362 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 28' ' ' ARG . 22.5 ttt180 -138.63 104.61 5.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.334 -0.848 . . . . 71.319999999999993 109.113 -174.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.7 t -121.14 175.84 5.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.43 0.633 . . . . 63.32 112.052 -170.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -130.34 17.54 5.43 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.019 -0.991 . . . . 72.230000000000004 110.58 -175.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -128.34 126.58 41.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 72.310000000000002 111.25 -177.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.663 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -76.95 -26.39 53.95 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.067 -0.515 . . . . 72.120000000000005 111.678 -177.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.9 t -68.71 -45.9 80.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.077 0.465 . . . . 74.329999999999998 109.842 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.15 -38.86 90.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.857 -0.611 . . . . 73.219999999999999 110.303 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.663 HD12 ' HA ' ' A' ' 32' ' ' ALA . 69.1 mt -58.37 -37.7 75.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 74.209999999999994 111.281 176.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.3 m -64.99 -37.05 86.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 51.530000000000001 110.276 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.423 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.74 -54.15 8.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.999 -0.546 . . . . 65.409999999999997 111.08 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.544 HG11 HD13 ' A' ' 27' ' ' LEU . 99.5 t -60.58 -38.78 79.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.247 -0.433 . . . . 73.5 111.075 -178.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.66 -51.48 58.44 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.864 -0.607 . . . . 74.340000000000003 112.196 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.23 72.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.644 0.259 . . . . 53.229999999999997 111.355 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 84.1 mt -65.69 -52.14 53.83 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.937 0.399 . . . . 62.020000000000003 110.725 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.4 mt -70.53 -39.1 74.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.919 -0.582 . . . . 74.299999999999997 110.563 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.73 -36.74 81.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 71.010000000000005 110.403 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.85 -24.25 62.51 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 121.047 -0.596 . . . . 64.109999999999999 113.067 -179.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.61 6.82 42.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.927 0.364 . . . . 74.120000000000005 111.464 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.1 t70 67.42 21.2 9.75 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.479 0.657 . . . . 64.420000000000002 110.372 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.804 HG22 ' HB3' ' A' ' 76' ' ' ASP . 78.5 mt -83.14 128.48 38.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.053 -0.521 . . . . 75.129999999999995 110.268 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.32 113.48 5.87 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.104 -0.57 . . . . 71.400000000000006 112.056 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.56 137.54 52.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.117 0.484 . . . . 74.430000000000007 111.431 -177.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.828 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 5.9 tt -107.79 95.17 5.5 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.901 -0.778 . . . . 75.239999999999995 108.901 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.447 HG11 HG21 ' A' ' 70' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 115.582 -0.736 . . . . 64.25 110.176 178.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo . . . . . 0 N--CA 1.454 -0.795 0 N-CA-C 110.251 -0.711 . . . . 65.400000000000006 110.251 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.464 ' HA ' ' NE ' ' A' ' 68' ' ' ARG . 5.3 mmp_? -127.57 150.83 49.54 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.46 0.648 . . . . 75.530000000000001 111.417 -175.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.488 ' HD3' ' OE1' ' A' ' 25' ' ' GLU . 18.9 ptp180 -114.72 136.85 52.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.832 -1.076 . . . . 74.329999999999998 108.948 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.592 ' HB ' ' HG ' ' A' ' 27' ' ' LEU . 97.8 t -108.52 114.4 46.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 120.953 0.406 . . . . 72.25 110.272 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.828 ' HB2' ' HB3' ' A' ' 50' ' ' LEU . 8.5 mp -101.53 140.12 36.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.573 -0.74 . . . . 71.430000000000007 109.4 176.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.864 HG22 HD22 ' A' ' 77' ' ' LEU . 23.9 m -126.16 162.94 28.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.325 0.583 . . . . 71.319999999999993 111.13 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.456 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 2.5 t-160 -74.22 162.19 29.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.079 -0.964 . . . . 70.340000000000003 110.257 -175.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.576 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 26.0 mm-40 -58.09 -58.88 6.49 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.85 0.685 . . . . 72.25 112.85 -174.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -73.33 -25.31 60.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.557 0.694 . . . . 72.239999999999995 110.041 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.804 ' HB3' HG22 ' A' ' 47' ' ' ILE . 1.5 m-20 -74.24 -14.65 60.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.168 -0.923 . . . . 63.539999999999999 110.63 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.864 HD22 HG22 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -53.49 -57.79 9.44 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.01 0.524 . . . . 71.040000000000006 111.249 -177.338 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.8 -38.34 90.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.691 -0.686 . . . . 70.129999999999995 111.04 -178.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.52 -44.99 94.37 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.902 -0.666 . . . . 74.420000000000002 112.124 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.58 97.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.728 0.299 . . . . 74.319999999999993 110.714 179.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -60.88 -50.94 71.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.43 . . . . 63.32 110.59 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -57.67 -43.95 85.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 64.510000000000005 110.819 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.6 tp -59.84 -54.74 42.67 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.028 -0.533 . . . . 72.030000000000001 111.054 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.483 HD23 HG12 ' A' ' 38' ' ' VAL . 90.4 mt -63.18 -30.78 71.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.996 -0.547 . . . . 75.310000000000002 111.385 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 88.4 m -66.79 -43.0 85.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.573 0.225 . . . . 72.349999999999994 110.812 178.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -69.09 -34.11 74.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.978 0.418 . . . . 60.509999999999998 110.582 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.95 -4.26 54.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.904 -0.589 . . . . 73.109999999999999 111.673 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 72.32 21.67 79.24 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.99 -0.624 . . . . 72.030000000000001 112.785 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.0 mt -105.47 10.26 33.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.08 0.467 . . . . 73.209999999999994 110.829 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.709 ' HA ' HD11 ' A' ' 93' ' ' LEU . . . -73.78 77.09 1.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.45 -0.574 . . . . 61.530000000000001 109.45 174.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -131.56 -51.22 0.99 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.332 -0.849 . . . . 71.439999999999998 110.421 -172.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -91.74 8.83 35.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.598 -0.728 . . . . 75.420000000000002 110.974 -176.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.709 HD11 ' HA ' ' A' ' 90' ' ' ALA . 9.3 mp -73.47 134.37 43.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.168 -0.469 . . . . 73.5 110.319 -178.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 53.3 mtt180 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.064 -0.516 . . . . 72.109999999999999 110.8 -177.263 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 110.045 -0.354 . . . . 62.020000000000003 110.045 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 102.24 126.66 5.9 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.599 -0.81 . . . . 61.43 112.951 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.4 t -130.94 125.47 33.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.648 -0.871 . . . . 70.219999999999999 108.648 173.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.3 m -139.78 117.96 11.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.112 0.482 . . . . 60.119999999999997 111.658 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -162.7 96.01 0.92 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.614 -0.721 . . . . 75.430000000000007 109.748 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -140.3 92.16 2.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.831 0.824 . . . . 72.409999999999997 111.194 178.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -131.68 85.75 2.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.743 -0.662 . . . . 74.430000000000007 109.825 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.3 t-80 -160.2 84.04 0.72 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.787 -0.642 . . . . 71.540000000000006 110.457 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -157.46 42.65 0.32 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.45 -0.574 . . . . 74.010000000000005 109.45 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 35.9 t-80 -83.98 86.92 7.12 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.975 -0.75 . . . . 74.010000000000005 108.975 176.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.6 m -155.07 102.66 2.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.695 -0.684 . . . . 63.109999999999999 109.92 -175.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -149.65 114.42 5.33 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.374 -0.376 . . . . 73.25 110.399 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -107.86 169.66 14.69 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.733 -0.746 . . . . 62.219999999999999 111.795 178.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -115.71 102.78 10.05 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.063 0.459 . . . . 73.519999999999996 110.792 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 C--N 1.325 -0.473 0 CA-C-O 121.035 0.445 . . . . 73.019999999999996 110.071 177.151 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 N--CA 1.463 0.219 0 CA-C-O 121.316 0.579 . . . . 74.049999999999997 110.027 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.48 ' HB2' HD23 ' A' ' 77' ' ' LEU . 87.7 mtt180 -107.11 147.78 29.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.082 -0.508 . . . . 73.409999999999997 110.189 -174.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.602 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 35.7 tt0 -72.83 136.67 45.41 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.529 -0.545 . . . . 73.010000000000005 109.529 177.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.587 HD11 HD23 ' A' ' 27' ' ' LEU . 1.4 tm? -97.75 -50.45 4.45 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.716 -0.476 . . . . 62.130000000000003 109.716 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.587 HD23 HD11 ' A' ' 26' ' ' LEU . 2.6 pt? -158.39 157.98 33.35 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.472 -0.331 . . . . 75.099999999999994 110.805 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.19 132.03 42.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.834 -0.621 . . . . 63.539999999999999 110.16 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.4 t -142.99 170.96 14.72 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.917 -0.401 . . . . 74.299999999999997 109.917 176.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.637 ' HA ' ' HA ' ' A' ' 67' ' ' PRO . 4.2 p-10 -116.67 9.63 14.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.347 0.594 . . . . 71.540000000000006 110.008 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -117.09 128.37 55.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.539 -0.755 . . . . 71.349999999999994 111.266 -175.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.696 ' HA ' HD13 ' A' ' 35' ' ' LEU . . . -77.54 -21.07 53.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.819 -0.628 . . . . 61.310000000000002 111.705 -176.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.7 t -69.18 -49.39 62.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.156 0.503 . . . . 75.329999999999998 109.849 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.5 tp -60.91 -37.51 82.52 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.641 -0.709 . . . . 63.340000000000003 110.231 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.696 HD13 ' HA ' ' A' ' 32' ' ' ALA . 78.5 mt -59.34 -35.15 73.32 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.98 -0.555 . . . . 61.299999999999997 111.072 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -69.74 -42.54 73.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.4 -0.364 . . . . 72.340000000000003 110.445 179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.77 -53.17 44.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 63.439999999999998 111.04 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.52 HG11 HD21 ' A' ' 84' ' ' LEU . 99.1 t -61.43 -40.57 86.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 121.127 0.489 . . . . 74.230000000000004 110.591 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.4 -48.48 85.97 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.685 -0.689 . . . . 73.209999999999994 111.979 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.63 -28.48 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 62.439999999999998 111.443 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 88.3 mt -67.13 -51.64 51.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.863 0.364 . . . . 72.049999999999997 110.559 177.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 82.5 mt -72.43 -39.11 68.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.98 -0.555 . . . . 75.120000000000005 110.665 -177.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -66.92 -41.2 87.45 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.463 -0.79 . . . . 73.230000000000004 110.666 -178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -80.08 -11.79 84.03 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.622 -0.799 . . . . 62.549999999999997 112.83 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -102.85 4.22 37.5 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.711 -0.288 . . . . 70.019999999999996 111.225 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.4 t70 63.15 32.48 15.11 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.682 0.753 . . . . 73.150000000000006 110.575 178.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 68.6 mt -93.58 130.09 43.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.884 -0.598 . . . . 63.119999999999997 110.308 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.18 117.96 6.59 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.929 -0.578 . . . . 62.32 112.165 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 54.0 p-80 -139.53 142.53 37.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.078 0.466 . . . . 74.329999999999998 110.935 -175.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 tp -113.31 115.82 28.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.971 -0.558 . . . . 73.230000000000004 110.824 -176.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.7 m . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.582 -0.736 . . . . 73.420000000000002 109.753 173.792 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.637 ' HA ' ' HA ' ' A' ' 30' ' ' ASN . 10.4 Cg_exo . . . . . 0 N--CA 1.46 -0.481 0 CA-C-O 121.005 0.335 . . . . 74.5 111.231 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.606 ' HB3' HD11 ' A' ' 35' ' ' LEU . 12.7 tpp180 -93.99 135.47 35.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.513 0.673 . . . . 75.310000000000002 110.952 -175.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.454 ' HD2' ' OE1' ' A' ' 25' ' ' GLU . 18.1 ptt180 -119.01 145.97 45.42 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.414 -0.812 . . . . 74.040000000000006 110.122 178.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.2 t -105.18 123.3 59.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.859 -0.609 . . . . 62.310000000000002 110.101 -177.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.602 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 9.6 mp -103.88 155.34 18.7 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.402 -0.592 . . . . 75.140000000000001 109.402 175.4 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.4 m -137.82 168.49 20.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.773 0.32 . . . . 62.130000000000003 110.399 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.43 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 27.6 m80 -73.42 160.51 31.65 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.95 -0.759 . . . . 73.519999999999996 108.95 176.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.32 -11.07 60.54 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.983 0.421 . . . . 72.409999999999997 110.849 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -91.71 -23.18 19.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.031 -0.532 . . . . 75.310000000000002 110.729 174.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.43 ' OD1' ' HB2' ' A' ' 73' ' ' HIS . 9.8 m-20 -93.76 -13.31 27.54 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.873 -0.603 . . . . 73.319999999999993 110.213 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.48 HD23 ' HB2' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -52.74 -57.08 11.29 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.639 -0.71 . . . . 74.420000000000002 111.183 -176.462 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.85 97.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.383 -0.371 . . . . 71.450000000000003 111.322 -177.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.8 -46.67 81.41 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.816 -0.706 . . . . 71.120000000000005 112.446 -177.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.51 -41.21 96.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.653 0.263 . . . . 73.310000000000002 111.413 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -60.47 -53.02 62.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.338 -0.392 . . . . 73.439999999999998 111.241 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -64.34 -32.62 74.3 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.704 0.261 . . . . 63.100000000000001 111.704 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.59 -54.65 32.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.783 0.325 . . . . 71.200000000000003 110.707 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.52 HD21 HG11 ' A' ' 38' ' ' VAL . 11.3 mp -65.46 -31.71 72.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 73.540000000000006 111.442 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.734 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 85.7 m -64.31 -46.28 84.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.739 0.304 . . . . 53.539999999999999 110.782 178.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.73 -29.79 69.11 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.036 0.446 . . . . 71.019999999999996 110.457 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.3 -14.79 60.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.183 -0.462 . . . . 74.230000000000004 111.131 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.64 9.57 66.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.798 -0.715 . . . . 73.099999999999994 112.415 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 79.9 mt -96.88 14.29 25.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.917 0.389 . . . . 71.549999999999997 110.727 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.769 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -71.57 80.6 0.81 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.035 -0.529 . . . . 52.119999999999997 110.668 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -134.96 -58.12 0.81 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.939 -0.573 . . . . 74.340000000000003 109.883 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.53 ' O ' ' HG3' ' A' ' 94' ' ' ARG . 77.0 mm-40 -90.67 7.84 37.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.221 -0.445 . . . . 74.299999999999997 111.751 -178.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.769 HD13 ' HA ' ' A' ' 90' ' ' ALA . 10.8 mp -61.29 118.94 7.55 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.811 -0.44 . . . . 71.129999999999995 109.811 176.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 92' ' ' GLU . 58.0 mtt180 . . . . . 0 C--N 1.322 -0.596 0 CA-C-O 121.566 0.698 . . . . 75.329999999999998 112.417 -172.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.479 1.024 0 CA-C-O 120.883 0.373 . . . . 64.310000000000002 110.416 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.02 130.16 5.36 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.868 -0.682 . . . . 74.319999999999993 111.879 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.0 p -121.69 -171.81 2.3 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.937 -0.394 . . . . 73.319999999999993 109.937 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.7 t -143.02 130.81 21.48 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.877 -0.416 . . . . 64.099999999999994 109.877 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -75.86 140.29 42.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.274 -0.421 . . . . 74.120000000000005 110.058 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -88.34 124.01 33.49 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.922 0.392 . . . . 73.329999999999998 111.275 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -146.55 166.3 26.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 74.129999999999995 110.355 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.1 p-80 -170.45 152.59 4.02 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.372 -0.603 . . . . 75.239999999999995 109.372 175.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -151.09 126.7 10.17 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.205 0.526 . . . . 73.019999999999996 111.801 -178.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -135.02 136.39 42.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.677 -0.692 . . . . 73.439999999999998 109.538 172.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.8 m -126.9 107.21 9.89 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.848 0.356 . . . . 73.230000000000004 110.579 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.0 m -110.66 112.3 24.09 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.153 -0.476 . . . . 73.299999999999997 110.531 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 155.63 142.43 3.43 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.506 -0.854 . . . . 74.530000000000001 112.816 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 14' ' ' ARG . 37.3 ttm180 -129.53 134.33 47.71 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.661 -0.496 . . . . 75.120000000000005 109.661 175.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 . . . . . 0 C--N 1.324 -0.506 0 CA-C-O 121.048 0.451 . . . . 75.430000000000007 110.922 -179.768 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . 6.0 mp . . . . . 0 C--O 1.231 0.125 0 N-CA-C 109.709 -0.478 . . . . 75.019999999999996 109.709 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.9 mmt180 -123.98 155.03 38.96 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.889 -0.411 . . . . 71.030000000000001 109.889 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -62.67 111.29 2.02 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 121.201 0.524 . . . . 73.099999999999994 110.813 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.6 tp -80.99 -23.03 39.01 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.166 -0.925 . . . . 72.109999999999999 108.809 175.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.48 ' HA ' ' HA ' ' A' ' 94' ' ' ARG . 0.7 OUTLIER 179.18 162.17 0.8 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.011 -0.995 . . . . 71.049999999999997 109.524 176.898 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -149.19 147.53 28.54 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.467 -0.568 . . . . 72.129999999999995 109.467 -179.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.4 t -170.1 169.36 7.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.979 0.419 . . . . 61.399999999999999 110.56 178.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -97.08 -8.8 29.38 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.909 -0.587 . . . . 74.450000000000003 110.678 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -82.28 148.54 28.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.375 -0.375 . . . . 74.329999999999998 110.625 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.63 -9.8 14.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.52 -0.309 . . . . 60.329999999999998 111.514 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.1 t -79.05 -43.53 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.289 0.566 . . . . 74.420000000000002 111.012 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.601 HD22 HD11 ' A' ' 89' ' ' LEU . 39.5 tp -70.1 -41.05 74.52 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.805 -0.634 . . . . 53.340000000000003 110.741 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.448 ' CD1' ' HB3' ' A' ' 68' ' ' ARG . 68.2 mt -64.87 -36.2 83.57 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.126 0.417 . . . . 73.329999999999998 112.126 -174.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.0 p -66.76 -29.7 69.73 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.99 0.424 . . . . 63.439999999999998 110.575 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -73.38 -42.95 61.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.452 . . . . 74.349999999999994 110.108 176.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.499 HG21 ' O ' ' A' ' 34' ' ' LEU . 61.6 t -57.3 -41.97 79.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.716 -0.675 . . . . 74.329999999999998 110.408 176.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -56.61 -50.59 62.12 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.41 -0.814 . . . . 74.430000000000007 112.305 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.94 -34.29 71.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.74 0.305 . . . . 73.0 111.406 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 83.5 mt -67.19 -46.46 73.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.111 0.482 . . . . 72.439999999999998 110.174 178.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.9 mt -69.12 -31.69 70.55 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.879 -0.601 . . . . 72.209999999999994 111.162 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -71.07 -38.72 72.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.266 -0.425 . . . . 61.130000000000003 110.081 175.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.01 -43.01 94.37 Favored Glycine 0 C--N 1.332 0.338 0 CA-C-N 115.956 -0.566 . . . . 74.420000000000002 112.452 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.4 -10.18 59.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.874 0.369 . . . . 72.409999999999997 110.66 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t70 61.92 34.65 16.75 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.386 -0.824 . . . . 73.409999999999997 110.906 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.2 mt -85.13 -29.35 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.724 0.773 . . . . 55.43 109.568 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.6 169.65 37.17 Favored Glycine 0 N--CA 1.447 -0.613 0 CA-C-N 114.987 -1.006 . . . . 63.219999999999999 111.595 -177.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -160.93 137.78 8.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.961 0.41 . . . . 71.430000000000007 111.954 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.469 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 2.8 tm? -109.75 103.25 12.05 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 107.755 -1.202 . . . . 70.209999999999994 107.755 168.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.588 HG13 HG21 ' A' ' 70' ' ' VAL . 3.1 m . . . . . 0 C--N 1.323 -0.551 0 CA-C-O 121.516 0.674 . . . . 63.25 111.493 -174.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo . . . . . 0 N--CA 1.447 -1.23 0 CA-C-O 121.012 0.338 . . . . 71.099999999999994 111.536 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.448 ' HB3' ' CD1' ' A' ' 35' ' ' LEU . 55.8 ttm-85 -89.32 136.31 33.09 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.908 -0.404 . . . . 74.219999999999999 109.908 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.99 141.94 46.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.239 -0.437 . . . . 75.409999999999997 110.362 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.588 HG21 HG13 ' A' ' 51' ' ' VAL . 48.1 t -102.38 106.94 20.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.663 -0.699 . . . . 74.510000000000005 109.838 177.566 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 10.3 mp -106.12 132.86 51.69 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.901 0.382 . . . . 71.439999999999998 111.103 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.3 m -120.77 155.25 24.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.307 -0.627 . . . . 65.030000000000001 109.307 173.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.422 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 7.5 t-80 -64.37 144.79 56.91 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.893 -0.41 . . . . 73.099999999999994 109.893 -178.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.499 ' HA ' HD21 ' A' ' 77' ' ' LEU . 42.6 mt-10 -71.6 69.23 0.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.299 0.571 . . . . 72.25 111.864 -176.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -141.98 -51.53 0.41 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.2 -0.909 . . . . 70.019999999999996 109.477 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -108.88 43.73 1.22 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.425 -0.807 . . . . 74.439999999999998 111.733 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.499 HD21 ' HA ' ' A' ' 74' ' ' GLU . 4.1 mm? -65.18 -52.89 52.13 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.712 -0.477 . . . . 61.009999999999998 109.712 175.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.9 -22.64 62.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.203 -0.453 . . . . 73.239999999999995 110.942 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.24 -48.05 15.92 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 121.04 -0.6 . . . . 75.120000000000005 112.017 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.04 -38.62 86.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.776 0.322 . . . . 60.109999999999999 110.467 177.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.438 HH11 ' HD2' ' A' ' 81' ' ' ARG . 21.0 mtp180 -62.1 -28.23 69.47 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.119 -0.491 . . . . 71.450000000000003 110.406 175.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -69.8 -51.1 36.69 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.497 -0.557 . . . . 73.409999999999997 109.497 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.3 tp -60.01 -51.65 68.75 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.113 -0.949 . . . . 64.230000000000004 111.631 -177.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.0 mp -63.05 -27.58 69.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 73.329999999999998 111.844 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.85 ' HA ' ' HB1' ' A' ' 90' ' ' ALA . 70.1 m -81.45 -43.24 19.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.824 0.345 . . . . 73.340000000000003 111.08 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.69 -44.14 78.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 71.310000000000002 110.881 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.09 87.86 1.22 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.227 -0.442 . . . . 73.150000000000006 110.717 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -172.47 -69.43 0.04 OUTLIER Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.447 -0.883 . . . . 33.530000000000001 111.987 176.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.679 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -164.12 -56.65 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.637 0.256 . . . . 74.400000000000006 110.937 -175.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.85 ' HB1' ' HA ' ' A' ' 85' ' ' THR . . . 60.6 13.37 4.19 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.72 -0.673 . . . . 71.340000000000003 112.168 -177.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -87.23 -40.99 14.04 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.131 -0.227 . . . . 74.450000000000003 110.992 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -93.5 -81.61 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.997 -0.281 . . . . 72.349999999999994 111.228 -177.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 96.1 mt 53.48 43.59 31.08 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.743 0.782 . . . . 71.310000000000002 109.521 -172.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.48 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 49.6 ttt180 . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 113.693 -1.594 . . . . 73.349999999999994 111.048 -173.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.736 0.303 . . . . 73.150000000000006 110.326 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.12 100.41 0.29 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.784 -0.722 . . . . 70.209999999999994 112.542 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.7 t -84.8 127.68 34.25 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.312 -0.625 . . . . 73.420000000000002 109.312 177.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.6 p -120.33 101.09 7.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.203 0.525 . . . . 54.439999999999998 111.061 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -158.81 118.91 3.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.702 -0.681 . . . . 53.219999999999999 110.617 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -149.98 115.86 5.62 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.537 -0.912 . . . . 75.519999999999996 108.537 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -93.41 106.21 18.2 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.389 -0.369 . . . . 73.049999999999997 110.689 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 24.1 p-80 -104.57 113.63 27.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.421 0.629 . . . . 72.519999999999996 110.936 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -149.37 108.03 3.83 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.592 -0.731 . . . . 73.519999999999996 109.918 174.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -160.72 125.9 3.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.135 -0.484 . . . . 63.229999999999997 110.515 -177.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.4 p -155.27 86.41 1.09 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.026 -0.533 . . . . 74.019999999999996 110.281 177.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.5 m -152.46 124.81 8.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.169 -0.469 . . . . 74.519999999999996 110.79 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 140.56 97.33 0.32 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.966 -0.635 . . . . 72.340000000000003 112.285 176.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.7 ttp180 -106.73 -41.1 5.32 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.496 -0.557 . . . . 71.040000000000006 109.496 177.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 . . . . . 0 C--O 1.236 0.39 0 CA-C-N 115.364 -0.835 . . . . 74.25 111.908 175.006 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.7 mp . . . . . 0 N--CA 1.468 0.468 0 CA-C-O 121.547 0.689 . . . . 75.219999999999999 111.783 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -125.36 166.04 17.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.459 -0.791 . . . . 73.400000000000006 109.162 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.775 ' HG2' ' HD2' ' A' ' 69' ' ' ARG . 2.0 mp0 -77.92 124.25 27.77 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.284 -0.635 . . . . 71.400000000000006 109.284 171.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.522 ' HB3' HD21 ' A' ' 27' ' ' LEU . 1.1 tm? -77.17 -30.73 55.03 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 108.801 -0.814 . . . . 74.5 108.801 177.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.522 HD21 ' HB3' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -170.08 160.53 8.17 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.563 -0.744 . . . . 73.230000000000004 110.84 -175.197 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HD3' ' HB3' ' A' ' 67' ' ' PRO . 6.0 tmm_? -127.56 106.48 9.2 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 107.0 -1.481 . . . . 74.439999999999998 107.0 170.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.509 HG23 HD21 ' A' ' 35' ' ' LEU . 14.6 t -78.25 164.2 25.1 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.482 0.658 . . . . 72.230000000000004 111.573 -166.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -114.7 -3.5 12.84 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.159 -0.928 . . . . 73.430000000000007 110.397 178.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -131.93 147.2 52.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.504 -0.316 . . . . 44.450000000000003 110.995 -175.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -93.74 -23.35 18.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.346 -0.388 . . . . 63.229999999999997 111.532 -175.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.0 t -79.18 -37.78 19.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.319 0.58 . . . . 71.099999999999994 110.0 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.3 tp -57.03 -32.25 65.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.413 -0.812 . . . . 72.099999999999994 111.284 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.509 HD21 HG23 ' A' ' 29' ' ' THR . 93.5 mt -56.08 -39.6 72.34 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.944 0.402 . . . . 74.409999999999997 111.446 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.4 m -64.95 -26.85 68.48 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.886 -0.597 . . . . 51.409999999999997 110.895 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.21 -47.9 10.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.267 -0.424 . . . . 61.340000000000003 110.639 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.406 ' HA ' HD11 ' A' ' 41' ' ' LEU . 86.4 t -58.58 -40.54 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.163 -0.472 . . . . 73.310000000000002 111.416 -179.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.03 -50.03 72.09 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.025 -0.607 . . . . 73.099999999999994 112.553 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.41 -27.22 69.15 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.895 0.378 . . . . 71.209999999999994 111.295 -177.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.427 ' HB3' HD23 ' A' ' 83' ' ' LEU . 91.9 mt -69.82 -51.66 31.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.966 -0.561 . . . . 75.25 110.168 177.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.4 mt -65.44 -40.21 93.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.669 -0.696 . . . . 54.130000000000003 110.919 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -64.63 -47.56 78.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.993 0.425 . . . . 75.209999999999994 110.662 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.09 -25.75 75.18 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.984 -0.627 . . . . 44.340000000000003 113.058 -176.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.74 1.63 56.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.681 0.241 . . . . 61.549999999999997 111.46 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.2 t70 64.86 33.19 10.28 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 122.001 0.905 . . . . 71.25 110.287 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.784 HG21 ' HB3' ' A' ' 76' ' ' ASP . 71.5 mt -88.25 128.27 40.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.353 -0.839 . . . . 73.140000000000001 110.394 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.69 99.16 0.9 Allowed Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.812 -0.515 . . . . 44.109999999999999 111.812 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -122.7 152.52 40.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.778 0.323 . . . . 70.010000000000005 110.887 -173.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.0 tp -129.03 104.8 7.78 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.873 -0.603 . . . . 43.43 110.159 177.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.3 m . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 116.095 -0.502 . . . . 65.450000000000003 110.708 177.081 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.505 ' HB3' ' HD3' ' A' ' 28' ' ' ARG . 22.3 Cg_exo . . . . . 0 N--CA 1.463 -0.301 0 CA-C-O 121.052 0.355 . . . . 72.340000000000003 111.308 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.523 ' HA ' ' CZ ' ' A' ' 68' ' ' ARG . 0.7 OUTLIER -97.35 138.11 35.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.219 -0.446 . . . . 74.230000000000004 110.723 -177.305 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.775 ' HD2' ' HG2' ' A' ' 25' ' ' GLU . 81.9 mtm180 -113.55 133.54 55.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.994 -0.548 . . . . 73.450000000000003 109.865 178.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.2 t -103.62 114.93 44.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.518 -0.549 . . . . 73.310000000000002 109.518 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.438 ' CD1' ' HG3' ' A' ' 25' ' ' GLU . 10.1 mp -103.59 144.18 31.77 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.851 0.358 . . . . 73.5 111.143 -177.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.478 HG23 HD21 ' A' ' 77' ' ' LEU . 26.2 m -141.5 167.27 16.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.682 -0.69 . . . . 75.450000000000003 109.811 176.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.507 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 14.1 m-70 -74.8 162.87 28.28 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.21 -0.663 . . . . 74.340000000000003 109.21 176.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.526 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 17.5 mt-10 -71.17 -18.62 62.48 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.214 -0.662 . . . . 74.409999999999997 109.214 174.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -66.87 -37.79 85.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.266 -0.879 . . . . 72.230000000000004 109.624 172.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.784 ' HB3' HG21 ' A' ' 47' ' ' ILE . 8.5 m-20 -97.45 -4.86 37.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.057 -0.974 . . . . 73.140000000000001 110.505 -175.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.615 ' O ' ' HG3' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -53.24 -58.26 7.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.837 -0.62 . . . . 73.219999999999999 111.233 -172.1 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.84 -32.72 72.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.801 0.334 . . . . 63.229999999999997 111.232 -177.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.76 -47.17 91.17 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.81 -0.709 . . . . 62.43 112.055 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.58 -40.8 80.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.504 0.193 . . . . 55.210000000000001 110.837 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.615 ' HG3' ' O ' ' A' ' 77' ' ' LEU . 21.0 mtp180 -57.36 -53.88 53.13 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.416 -0.357 . . . . 74.530000000000001 110.969 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -67.24 -37.55 83.71 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.833 -0.347 . . . . 71.430000000000007 110.864 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.427 HD23 ' HB3' ' A' ' 41' ' ' LEU . 60.6 tp -58.89 -54.94 41.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.072 0.463 . . . . 64.310000000000002 110.773 179.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.9 mt -66.09 -27.62 68.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.794 -0.639 . . . . 71.340000000000003 111.724 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.782 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 69.0 m -79.37 -42.7 24.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.768 0.318 . . . . 51.409999999999997 111.0 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.96 -43.91 70.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.997 -0.547 . . . . 62.100000000000001 112.261 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.49 23.72 4.39 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.397 0.517 . . . . 43.210000000000001 112.397 -175.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -121.01 -84.01 0.76 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.03 -1.081 . . . . 73.5 111.517 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.535 HD12 ' N ' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -178.35 -31.84 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.48 -0.36 . . . . 70.120000000000005 111.514 -175.832 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.782 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 59.36 24.58 13.16 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.818 0.342 . . . . 72.510000000000005 111.686 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . 0.406 ' H ' ' CD1' ' A' ' 89' ' ' LEU . 45.0 t60 -89.98 -22.76 21.76 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.337 -0.392 . . . . 71.129999999999995 111.164 -175.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -92.69 -8.32 44.3 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.291 -0.413 . . . . 63.140000000000001 111.686 -173.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.677 HD11 ' HA ' ' A' ' 90' ' ' ALA . 7.5 mp -70.42 94.59 0.97 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.148 0.499 . . . . 73.040000000000006 110.696 -176.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 115.757 -0.656 . . . . 74.430000000000007 111.739 -174.686 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 mmt . . . . . 0 N--CA 1.482 1.139 0 CA-C-O 120.695 0.284 . . . . 74.439999999999998 110.263 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 118.91 112.81 2.49 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.882 -0.675 . . . . 71.049999999999997 112.128 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.7 t -128.96 95.74 4.16 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.981 0.42 . . . . 72.129999999999995 109.951 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.0 m -147.84 147.9 30.29 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.653 -0.703 . . . . 73.400000000000006 109.669 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -137.37 105.68 5.76 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.297 0.57 . . . . 73.409999999999997 110.698 178.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -102.62 119.59 39.09 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.781 -0.645 . . . . 74.519999999999996 109.868 177.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -71.9 87.84 1.02 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.21 -0.45 . . . . 70.400000000000006 110.064 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -75.99 150.3 37.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.065 -0.516 . . . . 73.319999999999993 110.851 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -171.2 101.83 0.21 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.127 -0.488 . . . . 71.409999999999997 110.182 176.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -100.03 152.55 20.08 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.184 -0.462 . . . . 73.209999999999994 110.034 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.2 p -84.87 164.63 18.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.348 -0.387 . . . . 75.129999999999995 110.792 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.3 m -114.22 121.18 42.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.918 0.39 . . . . 62.109999999999999 110.505 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -170.56 103.41 0.19 Allowed Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.294 -0.722 . . . . 44.109999999999999 111.294 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.8 ptt180 -119.17 141.64 48.67 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.933 0.397 . . . . 74.329999999999998 110.919 -176.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.636 0 CA-C-N 115.784 -0.644 . . . . 75.109999999999999 109.594 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 121.028 0.442 . . . . 64.340000000000003 110.508 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.7 ' HB3' HD21 ' A' ' 77' ' ' LEU . 0.6 OUTLIER -143.84 127.19 16.77 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.766 -0.457 . . . . 74.319999999999993 109.766 -178.63 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.714 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 24.8 tt0 -68.38 117.87 10.72 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.096 -0.502 . . . . 74.540000000000006 109.646 178.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.705 HD13 HD21 ' A' ' 27' ' ' LEU . 2.7 tm? -93.64 -61.18 1.6 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.233 -0.44 . . . . 74.219999999999999 111.292 -171.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.705 HD21 HD13 ' A' ' 26' ' ' LEU . 2.6 pp -142.25 161.7 37.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.779 0.323 . . . . 71.540000000000006 111.063 -173.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -134.94 135.87 41.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.686 -0.688 . . . . 74.510000000000005 110.038 178.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.4 t -144.61 176.41 9.43 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.019 0.438 . . . . 74.549999999999997 110.943 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -117.72 -11.31 10.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.982 -0.553 . . . . 75.329999999999998 110.103 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -102.61 153.96 19.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.753 -0.658 . . . . 72.140000000000001 110.768 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -111.59 -11.28 14.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.252 -0.431 . . . . 54.240000000000002 111.239 -178.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.9 t -78.52 -43.93 26.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.918 0.39 . . . . 73.140000000000001 110.482 -178.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.657 HD22 HD13 ' A' ' 89' ' ' LEU . 66.1 tp -60.32 -31.6 70.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.891 -0.595 . . . . 73.120000000000005 110.797 177.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 77.6 mt -62.4 -22.64 66.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.583 -0.735 . . . . 71.510000000000005 111.754 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.3 m -60.83 -45.03 96.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.846 0.355 . . . . 53.140000000000001 110.362 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.506 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -68.06 -41.61 81.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.289 -0.414 . . . . 72.299999999999997 110.616 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 56.8 t -60.02 -45.35 95.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.94 -0.573 . . . . 73.230000000000004 110.27 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.44 -44.62 96.47 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.602 -0.726 . . . . 63.140000000000001 112.151 -179.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.36 -33.62 72.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.852 0.358 . . . . 72.129999999999995 110.986 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 91.2 mt -72.09 -47.77 48.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.13 -0.486 . . . . 62.210000000000001 110.7 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 91.4 mt -65.72 -47.42 75.39 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.113 -0.494 . . . . 60.43 110.809 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -42.27 98.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 74.319999999999993 110.836 178.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.32 -35.56 87.95 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.231 -0.509 . . . . 71.450000000000003 112.868 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.84 -0.01 55.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.619 0.247 . . . . 72.519999999999996 111.095 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.5 t70 61.38 35.76 17.74 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.999 0.904 . . . . 71.239999999999995 110.232 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.685 HG21 ' HB3' ' A' ' 76' ' ' ASP . 64.9 mt -88.8 119.73 36.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.156 -0.929 . . . . 74.030000000000001 110.57 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.82 137.0 46.98 Favored Glycine 0 C--N 1.332 0.307 0 N-CA-C 111.528 -0.629 . . . . 61.229999999999997 111.528 175.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 38.9 p-80 -152.56 138.57 18.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.114 0.483 . . . . 73.540000000000006 111.68 -171.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.0 tt -126.87 103.93 7.77 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.503 -0.771 . . . . 62.549999999999997 109.163 177.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 C--N 1.324 -0.508 0 N-CA-C 109.85 -0.426 . . . . 63.140000000000001 109.85 177.877 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo . . . . . 0 N--CA 1.463 -0.269 0 CA-C-O 120.859 0.275 . . . . 73.450000000000003 112.0 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 29.0 mmt-85 -101.84 113.33 26.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.192 -0.458 . . . . 75.519999999999996 109.838 -178.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -124.93 142.31 51.55 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.223 -0.591 . . . . 71.439999999999998 110.934 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.8 t -108.85 125.35 65.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.593 -0.73 . . . . 71.120000000000005 110.756 -174.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.714 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.0 mp -106.23 142.76 35.39 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.546 -0.538 . . . . 72.030000000000001 109.546 174.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.8 m -132.12 -178.41 2.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 109.847 -0.427 . . . . 62.310000000000002 109.847 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 76' ' ' ASP . 24.9 m170 -68.49 158.12 34.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.817 0.341 . . . . 74.230000000000004 110.724 177.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -38.78 84.39 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.221 -0.659 . . . . 73.030000000000001 109.221 174.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -73.4 -39.93 64.7 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.972 -1.013 . . . . 73.120000000000005 110.855 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.685 ' HB3' HG21 ' A' ' 47' ' ' ILE . 9.7 m-20 -78.34 -8.91 58.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.8 -0.636 . . . . 52.119999999999997 111.132 -178.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.75 HD13 ' HD3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -54.51 -46.2 73.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.041 0.448 . . . . 63.310000000000002 109.864 179.328 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.59 -36.64 79.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.506 -0.77 . . . . 63.119999999999997 111.357 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -78.49 -46.51 8.79 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.365 -0.921 . . . . 72.340000000000003 112.157 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.96 -47.9 73.08 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.911 0.337 . . . . 71.530000000000001 111.911 -175.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.75 ' HD3' HD13 ' A' ' 77' ' ' LEU . 15.5 ptt180 -68.56 -22.39 64.49 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.6 -0.44 . . . . 72.450000000000003 110.674 -176.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.4 ttp85 -78.2 -48.72 15.22 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.935 -0.395 . . . . 74.530000000000001 109.935 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 41.4 tp -59.56 -50.36 74.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.602 -0.726 . . . . 71.239999999999995 111.355 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.99 -27.87 68.47 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.929 -0.578 . . . . 73.25 111.917 -177.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.986 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 98.7 m -82.37 -37.35 25.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.791 0.329 . . . . 72.109999999999999 111.277 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -74.42 -44.69 50.73 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.944 0.349 . . . . 55.43 111.944 -176.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -142.95 35.65 1.39 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 111.851 0.315 . . . . 74.239999999999995 111.851 -174.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -124.63 -79.35 0.39 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.009 -1.091 . . . . 60.409999999999997 112.542 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.701 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -157.62 -56.66 0.08 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.756 0.313 . . . . 65.140000000000001 110.369 -175.099 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.986 ' HB3' ' HA ' ' A' ' 85' ' ' THR . . . 63.75 12.71 6.87 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.421 -0.809 . . . . 74.230000000000004 112.703 177.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -105.39 -26.56 11.91 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.334 -0.547 . . . . 74.319999999999993 111.191 -176.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 28' ' ' ARG . 13.5 mm-40 -97.84 -3.21 39.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.087 0.47 . . . . 51.43 110.758 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.652 HD11 ' HA ' ' A' ' 90' ' ' ALA . 9.7 mp -73.21 135.31 44.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.148 -0.478 . . . . 73.530000000000001 110.636 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 . . . . . 0 C--N 1.326 -0.449 0 CA-C-O 121.326 0.584 . . . . 75.329999999999998 110.581 -178.791 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ttt . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 120.889 0.376 . . . . 71.140000000000001 110.22 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 156.49 155.09 7.27 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 111.368 -0.693 . . . . 44.109999999999999 111.368 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.5 m -153.49 92.89 1.63 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.96 0.41 . . . . 70.329999999999998 110.639 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.2 p -107.83 66.93 0.67 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.453 0.644 . . . . 50.119999999999997 110.327 178.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -156.14 131.35 9.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.329 -0.85 . . . . 72.519999999999996 109.475 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -148.36 152.97 37.95 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.53 -0.304 . . . . 70.319999999999993 110.891 -177.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.6 t-80 -156.53 81.25 0.96 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.491 -0.559 . . . . 74.049999999999997 109.491 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -154.78 76.69 1.01 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.055 -0.52 . . . . 74.409999999999997 110.475 -175.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -177.11 114.17 0.09 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.349 -0.387 . . . . 65.340000000000003 110.962 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -163.58 17.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.026 0.441 . . . . 74.209999999999994 110.618 170.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.9 m -79.97 106.69 12.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.378 -0.373 . . . . 72.400000000000006 110.433 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.0 m -158.07 130.43 7.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.204 -0.453 . . . . 74.340000000000003 110.516 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 123.62 50.7 0.21 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.223 -0.989 . . . . 71.409999999999997 113.261 175.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -102.09 88.89 3.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.955 0.407 . . . . 75.109999999999999 110.512 174.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 115.875 -0.602 . . . . 64.519999999999996 110.662 177.448 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 CA--C 1.522 -0.111 0 N-CA-C 109.679 -0.489 . . . . 73.239999999999995 109.679 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 ttt180 -134.52 133.31 40.19 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.78 -0.452 . . . . 74.319999999999993 109.78 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.553 ' CA ' ' HG ' ' A' ' 71' ' ' LEU . 1.8 pt-20 -73.28 127.7 33.38 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.097 -0.705 . . . . 71.519999999999996 109.097 -179.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 45.3 tp -104.54 -29.84 10.4 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.579 -0.737 . . . . 72.409999999999997 111.132 -171.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -163.73 158.67 20.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.045 0.45 . . . . 75.129999999999995 111.253 -176.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -145.8 128.33 16.04 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.567 -0.901 . . . . 73.400000000000006 108.567 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.5 t -143.09 162.15 36.29 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.391 0.615 . . . . 73.329999999999998 111.698 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -106.77 2.03 25.33 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.256 -0.884 . . . . 65.5 110.414 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -96.54 119.9 35.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.981 -0.554 . . . . 75.319999999999993 109.822 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.32 -45.94 68.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.181 -0.463 . . . . 74.019999999999996 111.981 -174.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.2 t -66.51 -46.63 85.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.396 -0.365 . . . . 64.519999999999996 111.009 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.8 tp -61.59 -41.5 97.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.766 0.317 . . . . 71.140000000000001 110.396 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 68' ' ' ARG . 4.7 tt -59.46 -44.55 92.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.937 -0.574 . . . . 73.310000000000002 110.011 177.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.8 m -65.31 -41.54 93.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.868 -0.605 . . . . 71.319999999999993 110.711 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.417 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -62.01 -51.87 66.27 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.084 -0.507 . . . . 61.310000000000002 111.087 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.439 ' HA ' HD11 ' A' ' 41' ' ' LEU . 99.2 t -63.81 -40.46 89.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.089 0.471 . . . . 74.409999999999997 110.927 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.34 -42.24 99.72 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.796 -0.638 . . . . 72.430000000000007 112.297 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.08 -34.03 77.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.805 0.336 . . . . 63.0 110.825 178.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.543 ' HB3' HD23 ' A' ' 83' ' ' LEU . 97.8 mt -62.43 -49.1 76.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.285 0.564 . . . . 73.510000000000005 110.5 177.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.527 HD12 HG13 ' A' ' 70' ' ' VAL . 75.3 mt -70.94 -42.53 69.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.578 -0.737 . . . . 63.310000000000002 111.044 -176.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -67.13 -35.53 79.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.953 0.406 . . . . 64.430000000000007 110.627 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.1 -23.05 72.87 Favored Glycine 0 C--O 1.229 -0.194 0 C-N-CA 121.027 -0.606 . . . . 64.129999999999995 112.281 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.19 11.78 20.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.929 0.395 . . . . 61.299999999999997 110.528 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.0 t70 68.63 6.26 5.37 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.309 -0.86 . . . . 72.340000000000003 111.294 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 60.6 mt -73.6 -24.19 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.648 0.737 . . . . 61.43 109.042 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.05 -153.43 51.16 Favored Glycine 0 N--CA 1.441 -1.014 0 CA-C-N 114.779 -1.1 . . . . 55.030000000000001 111.573 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -173.15 143.39 1.12 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.654 0.264 . . . . 75.340000000000003 110.702 176.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.878 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 41.8 tp -108.45 88.28 2.69 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 108.781 -0.822 . . . . 62.210000000000001 108.781 168.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.523 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 24.0 m . . . . . 0 C--N 1.325 -0.459 0 CA-C-O 121.974 0.893 . . . . 54.43 109.644 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo . . . . . 0 N--CA 1.463 -0.295 0 N-CA-C 111.421 -0.261 . . . . 72.450000000000003 111.421 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.431 ' HB3' HD12 ' A' ' 35' ' ' LEU . 50.3 ttm-85 -62.03 136.91 58.16 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.058 -0.519 . . . . 73.519999999999996 109.997 -178.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.523 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 32.0 ptt180 -122.18 157.59 31.23 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.444 -0.343 . . . . 73.340000000000003 110.476 -175.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.527 HG13 HD12 ' A' ' 42' ' ' LEU . 24.7 t -112.53 116.32 52.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.833 -0.621 . . . . 63.009999999999998 110.393 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.878 ' HB2' ' HB3' ' A' ' 50' ' ' LEU . 8.9 mp -101.99 129.58 48.32 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.08 -0.509 . . . . 71.140000000000001 110.288 176.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 29.5 m -108.94 -173.68 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.585 -0.734 . . . . 65.209999999999994 109.571 177.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -97.59 143.71 28.0 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.839 -0.344 . . . . 74.019999999999996 110.621 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -40.19 -54.61 2.3 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.373 1.249 . . . . 54.43 114.373 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -80.8 -19.07 45.53 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.063 0.458 . . . . 73.450000000000003 111.196 -171.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -83.2 2.24 36.66 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.832 -0.622 . . . . 75.430000000000007 110.783 -177.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -54.89 -44.65 74.31 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.424 -0.353 . . . . 61.100000000000001 110.673 176.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.37 83.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.99 -0.55 . . . . 64.109999999999999 111.177 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -69.1 -46.7 57.48 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.661 -0.781 . . . . 41.310000000000002 111.862 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.21 96.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.681 -0.259 . . . . 73.219999999999999 111.582 -178.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 55.2 mtp85 -59.0 -48.64 80.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.998 -0.547 . . . . 64.409999999999997 111.357 -178.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -64.58 -45.69 85.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.989 0.423 . . . . 65.400000000000006 110.564 179.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.543 HD23 ' HB3' ' A' ' 41' ' ' LEU . 59.4 tp -55.67 -55.58 30.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.283 -0.872 . . . . 74.120000000000005 111.802 -175.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 68.7 mt -69.21 -32.06 71.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.243 -0.435 . . . . 71.129999999999995 111.745 -176.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 82.5 m -72.35 -44.84 62.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.599 0.238 . . . . 70.109999999999999 111.218 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -69.73 -25.65 63.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.032 0.444 . . . . 64.420000000000002 110.542 -178.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.66 -10.48 59.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.965 -0.562 . . . . 75.209999999999994 110.941 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 72.94 30.35 63.54 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.222 -0.513 . . . . 55.229999999999997 112.73 178.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.4 mt -118.29 17.74 13.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.055 0.455 . . . . 75.209999999999994 111.057 -178.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.622 ' HA ' HD11 ' A' ' 93' ' ' LEU . . . -77.83 85.43 4.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.252 -0.431 . . . . 60.439999999999998 110.29 178.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -141.18 -40.37 0.39 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.826 -0.624 . . . . 75.409999999999997 110.657 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -88.34 -1.28 57.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.463 -0.335 . . . . 73.319999999999993 111.349 -177.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.622 HD11 ' HA ' ' A' ' 90' ' ' ALA . 7.1 mp -65.97 118.42 9.74 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.998 -0.371 . . . . 72.420000000000002 109.998 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 C-N-CA 120.718 -0.393 . . . . 73.239999999999995 111.597 -172.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.5 ttp . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.002 -0.37 . . . . 72.140000000000001 110.002 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -172.46 45.38 0.17 Allowed Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.611 -0.596 . . . . 71.019999999999996 111.611 -179.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.6 p -88.07 83.4 7.01 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.214 0.531 . . . . 74.120000000000005 111.064 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t -124.2 113.84 18.84 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.108 -0.701 . . . . 62.200000000000003 109.108 179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -104.6 117.25 33.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.507 -0.315 . . . . 73.129999999999995 110.267 -175.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -145.63 105.67 4.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.179 -0.464 . . . . 75.340000000000003 109.862 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -168.23 32.92 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.306 0.575 . . . . 71.519999999999996 109.664 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 -80.66 129.51 34.56 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.774 -0.648 . . . . 74.150000000000006 110.886 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -141.1 107.73 5.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.274 -0.421 . . . . 61.149999999999999 110.754 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.458 ' HA ' ' OD2' ' A' ' 46' ' ' ASP . 55.8 t-80 -60.98 107.67 0.75 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.932 -0.576 . . . . 75.319999999999993 110.799 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.4 m -116.9 -1.01 12.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.122 0.487 . . . . 72.0 111.067 -178.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.6 p -87.52 88.99 7.83 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.243 0.544 . . . . 63.149999999999999 110.779 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -122.42 63.9 0.52 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.651 -0.785 . . . . 33.130000000000003 112.844 -177.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -163.03 111.18 1.26 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.982 0.42 . . . . 74.530000000000001 111.742 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.652 0 N-CA-C 108.416 -0.957 . . . . 72.140000000000001 108.416 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.435 HD21 HD23 ' A' ' 50' ' ' LEU . 6.6 mp . . . . . 0 N--CA 1.455 -0.221 0 CA-C-O 120.816 0.341 . . . . 72.439999999999998 110.893 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -127.41 155.77 43.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.837 -0.62 . . . . 70.25 110.957 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.839 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 42.7 tt0 -74.92 117.4 16.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.98 -0.555 . . . . 64.530000000000001 110.378 -179.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.481 ' HA ' HD21 ' A' ' 26' ' ' LEU . 10.0 mt -86.1 -45.34 11.48 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.069 -0.514 . . . . 75.0 111.566 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.1 tp -140.04 139.77 36.03 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.084 -0.507 . . . . 73.219999999999999 111.262 -165.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -115.49 94.94 4.92 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.331 -0.85 . . . . 73.239999999999995 108.712 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.404 ' O ' ' HB3' ' A' ' 68' ' ' ARG . 43.0 m -137.74 104.74 5.39 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.247 0.546 . . . . 74.340000000000003 112.403 -169.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -89.74 -1.05 57.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.246 0.546 . . . . 73.299999999999997 109.727 174.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -68.88 -33.98 74.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.142 -0.936 . . . . 75.209999999999994 111.682 -176.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 73.23 -50.85 0.7 Allowed 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.663 0.785 . . . . 75.219999999999999 112.096 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 56.3 t -66.64 -49.15 77.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.689 0.28 . . . . 62.020000000000003 110.521 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.5 tp -56.93 -38.29 72.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.197 0.522 . . . . 75.099999999999994 110.287 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.0 tt -63.69 -32.75 74.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 74.540000000000006 110.562 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.7 m -61.83 -37.04 82.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.995 0.426 . . . . 70.109999999999999 110.888 -179.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.3 -42.99 74.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 73.230000000000004 110.649 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 85.1 t -67.14 -42.49 88.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.008 -0.542 . . . . 74.420000000000002 110.612 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.96 -35.03 89.96 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.773 -0.649 . . . . 44.310000000000002 112.486 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -32.89 74.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.708 0.289 . . . . 63.109999999999999 110.796 178.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.3 mt -69.31 -49.5 55.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.462 . . . . 71.209999999999994 110.477 178.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.545 ' HA ' HD13 ' A' ' 47' ' ' ILE . 76.2 mt -62.75 -55.16 29.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.703 -0.68 . . . . 72.019999999999996 111.077 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.37 -25.07 67.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 72.439999999999998 111.214 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.53 -30.65 75.11 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 121.062 -0.589 . . . . 74.219999999999999 112.431 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -109.76 8.16 24.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.963 0.411 . . . . 54.420000000000002 110.63 178.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.458 ' OD2' ' HA ' ' A' ' 10' ' ' HIS . 26.2 t0 56.52 43.24 26.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 122.021 0.915 . . . . 64.030000000000001 110.623 -175.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.545 HD13 ' HA ' ' A' ' 42' ' ' LEU . 68.0 mt -67.66 -27.46 38.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 114.949 -1.023 . . . . 71.329999999999998 109.816 174.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.56 -178.79 35.52 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.163 -0.926 . . . . 73.439999999999998 111.468 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -165.81 125.31 1.69 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.018 0.437 . . . . 75.510000000000005 111.618 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.658 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 61.7 tp -105.88 100.14 9.7 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 107.988 -1.115 . . . . 73.329999999999998 107.988 166.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 21.9 m . . . . . 0 C--N 1.319 -0.729 0 CA-C-N 116.473 -0.331 . . . . 50.340000000000003 111.755 -172.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 N--CA 1.452 -0.96 0 CA-C-O 121.141 0.392 . . . . 65.430000000000007 111.41 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.404 ' HB3' ' O ' ' A' ' 29' ' ' THR . 24.0 ttm180 -72.97 117.85 15.2 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.268 -0.642 . . . . 73.109999999999999 109.268 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.428 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 8.9 ptp85 -113.84 134.48 54.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.783 -0.644 . . . . 72.140000000000001 111.236 -172.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 24.4 t -101.71 127.43 55.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.896 -0.593 . . . . 72.400000000000006 110.526 174.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.839 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.9 mp -121.66 147.68 45.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.794 -0.185 . . . . 63.329999999999998 111.115 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.491 HG23 HD21 ' A' ' 77' ' ' LEU . 35.7 m -134.67 178.76 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 109.441 -0.577 . . . . 75.510000000000005 109.441 173.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 23' ' ' LEU . 7.4 p80 -96.65 177.14 5.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.73 0.3 . . . . 63.310000000000002 111.635 -174.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.24 169.43 8.73 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.142 -0.481 . . . . 64.030000000000001 111.855 -178.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.1 t70 66.77 -65.39 0.21 Allowed 'General case' 0 N--CA 1.471 0.587 0 O-C-N 124.03 0.831 . . . . 64.319999999999993 109.877 -174.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -54.32 -26.56 30.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.677 -1.147 . . . . 70.420000000000002 111.164 176.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.491 HD21 HG23 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -50.03 -40.66 45.55 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.798 -0.637 . . . . 62.240000000000002 110.554 178.357 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.52 -41.46 69.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 63.5 110.872 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.23 -45.33 81.59 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.085 -0.579 . . . . 74.349999999999994 112.145 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.34 93.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.653 0.263 . . . . 75.150000000000006 110.855 178.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 30.1 mtp180 -60.2 -48.71 80.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.448 -0.342 . . . . 75.340000000000003 110.717 177.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -59.34 -40.52 86.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.062 -0.517 . . . . 73.319999999999993 110.688 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 42.0 tp -61.79 -49.45 76.31 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.888 -0.596 . . . . 73.299999999999997 110.809 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.6 mp -68.28 -29.03 67.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.088 -0.505 . . . . 51.039999999999999 111.4 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 51.1 m -69.56 -45.27 69.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.764 0.316 . . . . 63.200000000000003 110.251 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -62.4 -36.93 83.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 74.129999999999995 110.832 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.26 -18.09 60.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.92 -0.582 . . . . 74.099999999999994 111.153 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 83.02 23.37 55.53 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.123 -0.56 . . . . 55.140000000000001 113.02 177.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.1 mt -107.01 -3.03 20.51 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 122.541 -0.388 . . . . 51.32 111.186 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.764 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -75.56 86.23 2.65 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.352 -0.385 . . . . 61.240000000000002 111.152 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -147.16 -43.26 0.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.113 -0.494 . . . . 64.409999999999997 110.757 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -91.75 18.53 7.51 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.35 0.595 . . . . 60.299999999999997 110.69 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.764 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.7 mp -82.18 167.02 19.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.66 -0.7 . . . . 73.439999999999998 111.525 -177.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.58 ' HD2' ' OE1' ' A' ' 25' ' ' GLU . 28.0 ttt180 . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 115.471 -0.786 . . . . 71.319999999999993 109.4 177.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mpp? . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 110.085 -0.339 . . . . 72.109999999999999 110.085 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -174.17 70.15 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.998 -0.62 . . . . 71.019999999999996 111.839 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 m -106.94 26.18 10.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.976 0.417 . . . . 53.399999999999999 110.395 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.2 m -92.1 112.33 24.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.462 0.649 . . . . 74.120000000000005 111.525 -175.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.1 m170 -118.84 113.21 20.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.598 -0.728 . . . . 73.430000000000007 109.724 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -110.52 115.3 29.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.06 0.457 . . . . 74.019999999999996 109.903 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.4 p80 -151.76 134.74 15.74 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.973 -0.558 . . . . 73.349999999999994 110.429 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -150.97 123.66 8.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.833 -0.621 . . . . 74.010000000000005 110.086 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.76 88.54 1.41 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.355 -0.384 . . . . 75.329999999999998 110.551 -175.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -164.25 134.11 4.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.277 -0.638 . . . . 72.219999999999999 109.277 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.2 m -157.61 110.74 2.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.639 0.257 . . . . 63.539999999999999 111.282 -178.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 p -166.23 143.72 5.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 62.049999999999997 110.441 174.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 150.04 108.4 0.44 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.89 -0.672 . . . . 74.25 112.114 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 -173.41 -60.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.985 0.421 . . . . 72.099999999999994 110.383 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.438 -0.801 . . . . 72.120000000000005 111.816 -172.399 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.523 HD22 HD13 ' A' ' 50' ' ' LEU . 5.7 mp . . . . . 0 C--O 1.234 0.255 0 N-CA-C 110.149 -0.315 . . . . 74.329999999999998 110.149 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 24' ' ' ARG . 50.6 mtm180 -111.34 170.32 8.2 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.996 -0.372 . . . . 74.439999999999998 109.996 173.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.659 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 36.6 tt0 -81.82 135.06 35.47 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.79 0.329 . . . . 72.049999999999997 111.29 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.807 HD21 HG21 ' A' ' 72' ' ' VAL . 4.4 mm? -97.23 -67.19 0.86 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.056 -0.52 . . . . 71.340000000000003 110.034 175.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.606 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -142.82 157.9 44.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.24 -0.437 . . . . 72.430000000000007 110.559 177.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -138.01 101.73 4.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.828 -0.804 . . . . 63.509999999999998 108.828 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.0 t -113.59 170.25 8.38 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.242 -0.436 . . . . 74.310000000000002 110.525 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.462 HD21 ' HG2' ' A' ' 67' ' ' PRO . 11.1 m120 -104.57 -3.78 23.42 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.066 0.46 . . . . 74.530000000000001 109.768 177.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -105.98 156.71 18.1 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.734 -0.666 . . . . 73.430000000000007 111.174 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.73 -15.13 11.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.199 -0.455 . . . . 73.109999999999999 110.999 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 82.5 t -71.75 -49.51 45.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.007 0.432 . . . . 74.040000000000006 110.744 -177.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.4 tp -59.86 -31.78 70.09 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.886 -0.597 . . . . 72.109999999999999 110.684 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 76.3 mt -67.58 -22.98 65.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.506 . . . . 73.200000000000003 111.54 -178.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.6 m -67.97 -36.9 80.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.007 0.432 . . . . 73.129999999999995 110.238 176.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -72.18 -45.35 60.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 74.109999999999999 110.317 177.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.7 t -63.81 -42.77 96.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.76 -0.654 . . . . 61.549999999999997 110.972 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.35 -37.42 94.03 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.816 -0.629 . . . . 62.229999999999997 112.239 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.42 -31.3 72.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.758 0.314 . . . . 75.25 111.006 178.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 91.0 mt -70.42 -51.02 32.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.959 0.409 . . . . 74.430000000000007 110.159 177.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.649 ' HA ' HD11 ' A' ' 47' ' ' ILE . 48.3 mt -58.67 -52.87 63.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.602 -0.726 . . . . 72.319999999999993 110.969 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -67.75 -34.35 76.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.601 -0.727 . . . . 72.030000000000001 111.168 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.62 -15.2 61.51 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 116.12 -0.491 . . . . 63.25 112.443 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -100.76 -65.58 0.96 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.563 0.221 . . . . 64.329999999999998 110.609 176.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.0 t70 164.37 -19.78 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.402 -0.817 . . . . 73.329999999999998 109.09 -173.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.649 HD11 ' HA ' ' A' ' 42' ' ' LEU . 23.9 mt -51.04 106.41 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 114.179 -1.373 . . . . 74.219999999999999 112.869 -166.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.59 114.16 6.44 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.414 -0.812 . . . . 41.0 111.274 173.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -127.34 130.45 49.47 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.931 0.396 . . . . 75.319999999999993 110.647 -173.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.523 HD13 HD22 ' A' ' 23' ' ' LEU . 8.7 mp -106.66 112.16 25.02 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.858 -0.61 . . . . 75.319999999999993 110.05 179.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 C--N 1.323 -0.564 0 CA-C-N 115.86 -0.609 . . . . 72.349999999999994 110.512 179.143 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.462 ' HG2' HD21 ' A' ' 30' ' ' ASN . 21.9 Cg_exo . . . . . 0 N--CA 1.463 -0.272 0 CA-C-O 120.633 0.181 . . . . 71.319999999999993 111.76 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -158.08 116.63 3.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.11 -0.495 . . . . 75.340000000000003 110.367 175.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -113.91 132.41 55.94 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.739 -0.664 . . . . 75.109999999999999 109.33 177.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 52.2 t -109.74 118.49 56.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.405 -0.361 . . . . 73.120000000000005 110.448 -177.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.659 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.5 mp -125.74 144.37 50.65 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.996 -0.547 . . . . 62.200000000000003 109.914 177.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.807 HG21 HD21 ' A' ' 26' ' ' LEU . 33.2 m -127.68 165.66 26.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.931 -0.396 . . . . 75.340000000000003 109.931 177.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.48 ' ND1' ' HB3' ' A' ' 75' ' ' ASP . 0.4 OUTLIER -69.59 133.82 48.06 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.582 -0.281 . . . . 71.109999999999999 110.504 178.307 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.467 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 43.7 mm-40 -51.5 -28.46 13.55 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.137 0.575 . . . . 72.549999999999997 111.945 -177.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.48 ' HB3' ' ND1' ' A' ' 73' ' ' HIS . 34.9 t70 -58.4 -17.7 22.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.453 -0.794 . . . . 71.0 112.124 -179.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -131.59 13.24 4.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.157 0.503 . . . . 74.099999999999994 109.928 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.467 ' HB2' ' HA ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -57.3 -51.21 70.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.983 -0.553 . . . . 73.099999999999994 110.883 -174.441 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.16 -36.2 82.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.904 -0.589 . . . . 75.420000000000002 111.459 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.61 -47.39 21.32 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.627 -0.797 . . . . 71.230000000000004 111.956 -179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.05 -44.67 87.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.691 0.256 . . . . 71.400000000000006 111.691 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -59.68 -49.13 78.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.695 -0.229 . . . . 63.229999999999997 111.575 -177.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -65.56 -35.28 80.39 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.424 -0.51 . . . . 72.400000000000006 110.712 -178.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.2 tp -61.97 -43.07 99.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.932 0.396 . . . . 75.329999999999998 110.211 178.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.73 -28.54 66.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.0 -0.546 . . . . 74.310000000000002 111.236 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.458 ' HA ' ' HB1' ' A' ' 90' ' ' ALA . 19.2 m -77.33 -48.81 16.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.164 0.507 . . . . 64.010000000000005 110.781 176.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.04 -44.39 76.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.167 -0.924 . . . . 65.019999999999996 112.122 -171.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -123.06 28.3 7.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.89 0.376 . . . . 71.230000000000004 111.747 -175.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -139.96 -80.98 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.103 -1.046 . . . . 73.540000000000006 112.252 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.531 HD13 ' OE1' ' A' ' 92' ' ' GLU . 0.6 OUTLIER -179.12 -57.12 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 122.321 0.248 . . . . 63.009999999999998 111.187 -173.434 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.961 ' HA ' HD11 ' A' ' 93' ' ' LEU . . . 60.12 20.99 10.24 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.025 0.53 . . . . 74.439999999999998 112.055 -177.048 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . 0.446 ' H ' HD11 ' A' ' 89' ' ' LEU . 57.1 t-80 -100.67 -29.27 12.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.089 0.471 . . . . 73.129999999999995 110.651 -176.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.531 ' OE1' HD13 ' A' ' 89' ' ' LEU . 5.4 mp0 -94.75 6.96 47.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.823 -0.626 . . . . 75.450000000000003 110.701 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.961 HD11 ' HA ' ' A' ' 90' ' ' ALA . 11.1 mp -73.13 150.61 42.08 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.205 -0.452 . . . . 74.150000000000006 110.701 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 94' ' ' ARG . 22.3 ttt85 . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 115.533 -0.758 . . . . 75.120000000000005 109.755 -173.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 mmt . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.748 0.308 . . . . 52.439999999999998 110.201 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 106.98 56.9 0.61 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.929 -0.653 . . . . 63.329999999999998 112.299 177.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.7 m -116.82 78.54 1.22 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.037 0.446 . . . . 71.25 110.697 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.2 m -127.03 144.52 51.0 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.08 -0.509 . . . . 73.010000000000005 110.435 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -134.71 101.58 4.98 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.182 -0.673 . . . . 73.030000000000001 109.182 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.7 t60 -135.58 125.94 26.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.856 -0.611 . . . . 75.439999999999998 111.165 -172.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -150.3 132.98 15.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.157 -0.474 . . . . 71.519999999999996 109.903 173.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 t60 -132.8 108.95 9.31 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.724 -0.473 . . . . 73.010000000000005 109.724 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -152.04 98.5 2.44 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.302 -0.408 . . . . 74.439999999999998 111.107 -175.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -157.14 113.0 2.9 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.354 0.597 . . . . 55.530000000000001 110.344 173.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.7 m -134.5 137.23 43.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.6 -0.727 . . . . 75.129999999999995 109.661 178.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.3 m -139.55 167.04 22.99 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.038 -0.528 . . . . 73.209999999999994 110.122 -176.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 141.51 85.52 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.131 -1.033 . . . . 75.109999999999999 113.728 174.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 17.1 ptt180 -149.82 100.88 3.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.233 0.539 . . . . 73.439999999999998 110.692 172.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 116.019 -0.537 . . . . 73.140000000000001 110.275 178.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 93.2 mt . . . . . 0 N--CA 1.467 0.393 0 CA-C-O 121.205 0.526 . . . . 74.319999999999993 110.509 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.516 ' HB2' HD23 ' A' ' 77' ' ' LEU . 27.8 mmm180 -132.74 127.52 34.88 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.992 -0.442 . . . . 71.329999999999998 110.889 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.523 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 42.5 tt0 -70.56 120.93 16.92 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.557 -0.747 . . . . 74.340000000000003 109.05 174.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.46 HD13 HD23 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -79.6 -51.96 8.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.889 0.376 . . . . 74.530000000000001 110.098 -174.895 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.46 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 pt? -157.4 154.53 29.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.177 -0.465 . . . . 74.430000000000007 110.701 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.567 ' HG3' ' HB3' ' A' ' 69' ' ' ARG . 22.1 ttm180 -131.7 111.41 11.65 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.702 -0.851 . . . . 74.239999999999995 108.702 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.7 t -126.92 164.7 20.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.138 0.494 . . . . 72.340000000000003 111.523 -173.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.433 ' ND2' ' HB3' ' A' ' 67' ' ' PRO . 8.1 m120 -107.88 -6.89 16.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.655 -0.702 . . . . 74.439999999999998 109.955 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -95.45 134.47 38.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.763 -0.653 . . . . 75.040000000000006 111.332 -175.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.35 -33.26 49.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.813 -0.63 . . . . 73.400000000000006 111.587 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.1 t -59.96 -47.44 91.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 120.93 0.395 . . . . 63.049999999999997 110.69 -177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.3 tp -62.22 -40.24 95.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.672 -0.695 . . . . 75.340000000000003 110.572 178.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.63 -43.41 98.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 72.049999999999997 111.081 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.6 m -59.5 -40.78 88.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.791 0.329 . . . . 64.109999999999999 111.016 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -71.97 -54.64 9.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.117 -0.492 . . . . 65.349999999999994 111.181 -177.528 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.43 HG11 HD22 ' A' ' 84' ' ' LEU . 86.9 t -61.26 -39.53 82.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.194 0.521 . . . . 73.450000000000003 110.315 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.82 -49.0 80.33 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.351 -0.841 . . . . 71.310000000000002 112.262 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.28 -33.02 74.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.639 0.257 . . . . 74.319999999999993 111.305 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 95.0 mt -65.68 -51.78 56.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.323 -0.399 . . . . 63.420000000000002 110.678 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.6 mt -74.39 -27.3 60.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.113 -0.494 . . . . 72.129999999999995 110.671 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -74.91 -55.63 5.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.13 -0.486 . . . . 74.099999999999994 110.631 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.66 -36.2 92.06 Favored Glycine 0 C--N 1.332 0.31 0 CA-C-N 115.698 -0.683 . . . . 70.310000000000002 112.84 -175.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.47 ' HB1' HG12 ' A' ' 47' ' ' ILE . . . -82.81 -1.69 52.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.763 0.316 . . . . 72.219999999999999 110.747 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.2 t70 60.72 26.78 16.55 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.462 0.648 . . . . 74.319999999999993 111.067 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.47 HG12 ' HB1' ' A' ' 45' ' ' ALA . 47.2 mm -63.64 -39.32 84.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.532 0.682 . . . . 75.349999999999994 110.106 -179.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 110.64 125.79 4.9 Favored Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.208 -0.905 . . . . 61.539999999999999 112.276 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -139.0 141.81 38.32 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.71 0.291 . . . . 73.25 110.683 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.6 90.67 3.37 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.313 -0.995 . . . . 74.530000000000001 108.313 171.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.9 m . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.974 -0.557 . . . . 72.409999999999997 111.499 -175.581 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . 0.433 ' HB3' ' ND2' ' A' ' 30' ' ' ASN . 37.3 Cg_endo . . . . . 0 C--O 1.235 0.345 0 CA-C-O 120.932 0.305 . . . . 61.229999999999997 111.708 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.474 ' HA ' ' HD2' ' A' ' 68' ' ' ARG . 10.1 tpt180 -100.87 140.81 34.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.38 0.61 . . . . 75.329999999999998 110.985 -177.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.567 ' HB3' ' HG3' ' A' ' 28' ' ' ARG . 28.3 ptt180 -113.61 146.69 39.35 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.135 -0.939 . . . . 74.109999999999999 110.357 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 64.6 t -110.04 116.75 53.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.415 -0.357 . . . . 73.349999999999994 110.444 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.523 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.7 mp -102.79 137.62 40.76 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.548 -0.538 . . . . 71.239999999999995 109.548 174.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 25.3 m -114.99 176.9 2.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.227 -0.442 . . . . 65.340000000000003 110.504 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -69.9 129.33 39.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.686 -0.688 . . . . 75.319999999999993 109.519 176.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -57.75 -35.93 71.39 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.006 0.431 . . . . 64.049999999999997 111.125 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.6 -16.91 61.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.731 -0.668 . . . . 63.409999999999997 110.142 -176.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -111.33 23.62 13.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.964 -0.562 . . . . 71.540000000000006 110.093 -175.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.516 HD23 ' HB2' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -51.32 -50.86 58.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.753 -0.658 . . . . 71.099999999999994 110.711 -178.436 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.13 -28.37 66.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.019 -0.537 . . . . 72.319999999999993 111.622 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.42 -57.23 5.18 Favored Glycine 0 C--O 1.236 0.23 0 C-N-CA 120.718 -0.754 . . . . 71.409999999999997 112.611 -175.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.38 -42.87 96.75 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.889 0.329 . . . . 73.120000000000005 111.889 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 14.6 ptm180 -67.22 -33.23 74.91 Favored 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 120.943 -0.303 . . . . 72.329999999999998 110.91 -178.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -63.0 -42.28 99.81 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.016 0.436 . . . . 73.530000000000001 109.852 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 34.8 tp -58.49 -46.99 85.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.6 -0.727 . . . . 70.5 110.451 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.43 HD22 HG11 ' A' ' 38' ' ' VAL . 84.0 mt -68.49 -32.46 72.47 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.768 -0.651 . . . . 64.310000000000002 111.226 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.6 m -70.37 -36.82 74.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.975 0.417 . . . . 64.129999999999995 110.551 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -69.04 -40.58 78.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.019 -0.537 . . . . 64.019999999999996 110.445 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.48 -30.16 69.78 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.868 -0.605 . . . . 73.200000000000003 111.044 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 100.29 -13.79 59.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.121 -0.562 . . . . 73.319999999999993 112.673 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 61.6 mt -78.91 1.9 21.99 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.178 0.436 . . . . 63.530000000000001 112.178 -176.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -75.73 91.32 2.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.056 0.455 . . . . 62.119999999999997 109.827 175.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -140.46 -40.32 0.42 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.904 -0.589 . . . . 75.129999999999995 110.001 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.6 mp0 -87.39 29.63 0.85 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.627 -0.715 . . . . 74.109999999999999 111.492 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.471 HD12 ' H ' ' A' ' 93' ' ' LEU . 4.1 mp -62.81 145.1 55.76 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.705 0.288 . . . . 72.510000000000005 110.482 -178.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.419 ' HD2' ' HA ' ' A' ' 94' ' ' ARG . 2.3 tpt180 . . . . . 0 C--N 1.323 -0.585 0 N-CA-C 109.728 -0.471 . . . . 71.450000000000003 109.728 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.484 1.255 0 CA-C-O 120.529 0.204 . . . . 72.25 110.986 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.18 127.59 0.92 Allowed Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 120.222 -0.99 . . . . 54.119999999999997 113.065 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.2 p -153.4 82.24 1.18 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.224 -0.658 . . . . 64.439999999999998 109.224 173.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.3 p -89.51 117.76 28.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.78 -0.645 . . . . 74.140000000000001 111.471 -172.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -139.37 111.44 7.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.087 -0.708 . . . . 73.430000000000007 109.087 176.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.6 p-80 -153.38 107.26 3.04 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.081 0.467 . . . . 70.140000000000001 111.18 -177.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -150.7 102.34 3.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.893 -0.594 . . . . 73.030000000000001 111.138 175.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -140.79 118.86 11.92 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.351 -0.611 . . . . 74.209999999999994 109.351 171.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -146.13 95.22 2.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.224 -0.444 . . . . 72.400000000000006 110.639 -177.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -131.76 53.23 2.01 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.814 -0.81 . . . . 75.409999999999997 108.814 174.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -72.46 90.87 1.34 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.324 -0.853 . . . . 72.200000000000003 110.813 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.3 p -121.4 -178.13 3.71 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.84 -0.618 . . . . 75.209999999999994 110.32 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 106.76 90.17 2.14 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.779 -0.724 . . . . 64.019999999999996 111.691 -179.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 14' ' ' ARG . 10.4 ttp180 -76.64 -65.17 0.97 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.641 -0.503 . . . . 62.329999999999998 109.641 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.302 -0.863 . . . . 72.340000000000003 110.093 -176.142 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.766 HD21 ' HB2' ' A' ' 50' ' ' LEU . 7.4 mp . . . . . 0 CA--C 1.531 0.242 0 CA-C-O 121.665 0.745 . . . . 64.530000000000001 111.518 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.606 ' HB2' HD11 ' A' ' 77' ' ' LEU . 13.1 mmt180 -115.2 133.18 56.27 Favored 'General case' 0 C--N 1.321 -0.668 0 O-C-N 121.831 -0.543 . . . . 65.530000000000001 110.545 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.595 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.5 tt0 -66.93 126.96 30.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.22 -0.9 . . . . 75.329999999999998 110.409 -176.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.456 ' CD1' ' HG2' ' A' ' 81' ' ' ARG . 20.2 tp -106.61 -58.21 1.96 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.41 -0.814 . . . . 72.040000000000006 110.772 -175.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.824 ' HB3' HD23 ' A' ' 93' ' ' LEU . 4.6 pp -147.71 167.99 23.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.388 -0.369 . . . . 71.150000000000006 110.1 178.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HD2' ' O ' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -148.02 143.91 27.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.88 0.372 . . . . 75.129999999999995 111.527 179.213 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.8 t -174.02 163.17 3.96 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.605 -0.725 . . . . 73.129999999999995 109.995 178.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -100.06 -4.23 30.3 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.958 0.409 . . . . 54.25 109.924 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.8 117.68 17.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.766 -0.652 . . . . 75.439999999999998 110.344 -177.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.471 ' HB1' HH22 ' A' ' 68' ' ' ARG . . . -74.57 -38.44 62.68 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.323 -0.399 . . . . 64.420000000000002 111.263 -176.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.2 t -63.44 -46.44 95.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.088 0.471 . . . . 74.430000000000007 110.459 -177.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 tp -61.39 -39.95 92.56 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.696 -0.684 . . . . 70.450000000000003 110.584 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.541 ' HA ' HG13 ' A' ' 38' ' ' VAL . 80.9 mt -72.11 -24.65 61.52 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.957 -0.565 . . . . 75.239999999999995 111.514 -178.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -75.05 -27.59 60.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.945 0.403 . . . . 71.329999999999998 110.306 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.62 -53.74 7.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 71.409999999999997 110.582 177.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.707 HG21 HD22 ' A' ' 27' ' ' LEU . 7.2 p -64.92 -35.37 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 120.915 0.388 . . . . 65.439999999999998 111.153 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.37 -38.97 95.53 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.004 -0.617 . . . . 64.439999999999998 112.307 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.96 -29.98 70.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.878 0.371 . . . . 74.109999999999999 111.135 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 88.0 mt -69.39 -49.18 57.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.127 -0.488 . . . . 63.210000000000001 109.968 178.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.9 mt -66.15 -35.0 79.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.672 -0.695 . . . . 74.349999999999994 110.589 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.12 -52.43 48.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.769 -0.651 . . . . 73.109999999999999 110.737 176.196 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.53 -26.88 73.57 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.689 -0.687 . . . . 71.230000000000004 113.966 -173.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.02 9.11 37.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.835 0.318 . . . . 74.430000000000007 111.826 -177.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.6 t70 61.17 29.13 18.63 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.753 0.787 . . . . 73.510000000000005 110.732 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.3 mt -84.26 -47.62 17.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.541 0.686 . . . . 65.209999999999994 110.185 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.21 172.74 38.67 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.083 -0.962 . . . . 73.439999999999998 111.601 -176.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -169.24 142.13 2.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.946 0.403 . . . . 73.239999999999995 111.406 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.766 ' HB2' HD21 ' A' ' 23' ' ' LEU . 1.9 tm? -97.19 102.25 13.98 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.355 -0.98 . . . . 74.230000000000004 108.355 172.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.7 m . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.977 -0.556 . . . . 64.129999999999995 110.468 -179.611 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo . . . . . 0 N--CA 1.458 -0.581 0 N-CA-C 110.237 -0.717 . . . . 73.340000000000003 110.237 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.471 HH22 ' HB1' ' A' ' 32' ' ' ALA . 64.5 mtm180 -75.83 126.46 31.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.671 0.748 . . . . 73.140000000000001 112.337 -170.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -113.13 131.43 55.84 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.584 -1.189 . . . . 72.329999999999998 108.023 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 55.5 t -101.45 111.6 31.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-O 120.769 0.319 . . . . 75.439999999999998 110.772 -172.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.626 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 7.7 mp -102.73 142.73 33.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.639 -0.71 . . . . 74.0 109.104 174.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 20.6 m -119.96 174.26 5.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.204 0.526 . . . . 73.329999999999998 111.484 -174.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.55 ' HD1' ' HB2' ' A' ' 76' ' ' ASP . 32.7 t-80 -57.69 121.89 11.48 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.812 -1.086 . . . . 64.049999999999997 110.949 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.556 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 36.9 mt-10 -62.87 154.0 31.47 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.879 -0.6 . . . . 71.219999999999999 109.459 177.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.556 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 8.6 t70 78.92 -16.79 0.64 Allowed 'General case' 0 N--CA 1.473 0.689 0 O-C-N 123.921 0.763 . . . . 71.349999999999994 111.213 -173.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.55 ' HB2' ' HD1' ' A' ' 73' ' ' HIS . 0.4 OUTLIER -104.36 16.87 25.25 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.159 0.504 . . . . 74.510000000000005 110.246 -177.516 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.606 HD11 ' HB2' ' A' ' 24' ' ' ARG . 4.2 mm? -60.94 -49.09 78.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.671 -0.695 . . . . 61.340000000000003 111.295 -177.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.42 -22.46 66.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.912 0.387 . . . . 73.209999999999994 111.192 -178.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -84.61 -56.08 2.57 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.642 -0.79 . . . . 65.219999999999999 112.541 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.422 ' O ' HD11 ' A' ' 84' ' ' LEU . . . -61.17 -44.42 97.34 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.749 0.277 . . . . 73.340000000000003 111.749 -176.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.456 ' HG2' ' CD1' ' A' ' 26' ' ' LEU . 18.3 mtp180 -63.13 -36.96 85.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.937 0.399 . . . . 62.130000000000003 110.243 -178.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -68.34 -44.07 76.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.993 -0.548 . . . . 73.420000000000002 110.582 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.5 tp -56.28 -49.87 73.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 74.25 111.019 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.422 HD11 ' O ' ' A' ' 80' ' ' ALA . 9.1 mp -67.67 -28.23 67.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 75.340000000000003 111.416 -178.395 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.614 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 61.3 m -81.08 -40.02 24.79 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.47 -0.332 . . . . 74.519999999999996 111.211 -178.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -74.22 -42.28 60.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.27 -0.423 . . . . 63.420000000000002 111.217 -177.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.8 83.82 1.09 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.12 0.486 . . . . 62.109999999999999 110.361 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -170.33 -96.1 0.1 Allowed Glycine 0 N--CA 1.441 -1.01 0 C-N-CA 120.323 -0.942 . . . . 44.299999999999997 112.429 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.613 HD13 ' HB ' ' A' ' 38' ' ' VAL . 1.2 pp -175.0 48.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.197 0.522 . . . . 71.150000000000006 111.182 -172.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.614 ' HB3' ' HA ' ' A' ' 85' ' ' THR . . . -68.44 93.79 0.51 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.173 -0.467 . . . . 63.32 111.587 -177.034 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -151.14 -47.91 0.12 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.061 -0.518 . . . . 74.530000000000001 110.187 176.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -76.73 -0.3 23.19 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.64 -0.709 . . . . 75.340000000000003 110.869 -178.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.824 HD23 ' HB3' ' A' ' 27' ' ' LEU . 90.5 mt -66.91 140.47 57.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.004 -0.544 . . . . 73.299999999999997 110.671 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 . . . . . 0 C--N 1.324 -0.525 0 C-N-CA 120.85 -0.34 . . . . 74.310000000000002 110.193 175.94 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 109.775 -0.454 . . . . 63.119999999999997 109.775 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 174.82 -62.2 0.11 Allowed Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.591 -0.814 . . . . 60.310000000000002 112.216 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.4 m -105.38 101.13 10.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.863 0.363 . . . . 61.329999999999998 110.538 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.2 p -121.69 107.63 12.58 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.041 -0.527 . . . . 72.519999999999996 110.4 177.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -113.58 127.07 55.93 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.548 0.689 . . . . 73.329999999999998 111.505 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -157.04 93.75 1.36 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.889 -1.051 . . . . 72.430000000000007 108.699 175.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -148.8 154.68 39.88 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.367 -0.833 . . . . 60.409999999999997 110.33 -173.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.1 p-80 -156.39 143.12 18.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.826 0.346 . . . . 72.420000000000002 110.739 -177.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -139.82 91.19 2.45 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.944 -0.571 . . . . 71.400000000000006 109.487 177.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -142.0 109.05 5.47 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.047 0.451 . . . . 74.030000000000001 110.563 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.7 t -82.13 -175.78 5.82 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.697 -0.683 . . . . 70.319999999999993 109.376 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.8 m -81.15 78.54 7.94 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.055 0.455 . . . . 74.219999999999999 110.391 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -118.46 134.13 10.74 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.881 -0.675 . . . . 71.219999999999999 111.802 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 14' ' ' ARG . 30.6 ttt180 -164.41 125.54 2.17 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.829 0.347 . . . . 73.420000000000002 110.287 -179.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.319 -0.76 0 N-CA-C 109.411 -0.589 . . . . 73.230000000000004 109.411 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.501 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . 72.8 mt . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.552 0.215 . . . . 74.420000000000002 110.674 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.762 HH11 ' HG ' ' A' ' 77' ' ' LEU . 43.1 mtp180 -126.31 135.36 51.41 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.895 -0.409 . . . . 70.0 109.895 174.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.535 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.7 tt0 -68.77 110.47 4.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.04 -0.527 . . . . 74.209999999999994 109.711 177.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.5 tp -88.82 -52.18 5.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 111.131 -174.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 2.4 pt? -151.41 149.12 28.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.568 -0.287 . . . . 74.540000000000006 110.46 179.2 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -139.59 137.34 35.28 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.979 -0.378 . . . . 74.120000000000005 109.979 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.1 t -156.39 -175.7 5.57 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.143 -0.481 . . . . 73.530000000000001 109.973 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -106.78 -3.19 20.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.012 0.434 . . . . 71.109999999999999 110.614 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -107.28 134.75 49.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.959 -0.564 . . . . 74.310000000000002 111.252 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -93.76 -17.31 23.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.096 -0.502 . . . . 50.130000000000003 110.941 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t -65.24 -53.24 42.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-O 120.926 0.393 . . . . 74.019999999999996 110.451 -178.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.91 -34.48 78.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.189 -0.459 . . . . 74.010000000000005 110.732 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 66.7 mt -66.94 -32.03 73.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.447 -0.342 . . . . 51.399999999999999 111.032 179.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.9 m -67.52 -28.5 67.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.063 0.459 . . . . 74.150000000000006 110.333 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.465 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.87 -42.16 61.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.095 -0.502 . . . . 75.129999999999995 109.926 174.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.603 HG12 HD21 ' A' ' 84' ' ' LEU . 92.6 t -63.17 -45.35 98.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.646 -0.706 . . . . 61.100000000000001 110.721 176.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.47 -40.57 96.36 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.811 -0.632 . . . . 63.409999999999997 112.478 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.44 -33.43 74.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 72.439999999999998 111.184 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 87.2 mt -69.51 -51.28 37.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.147 0.498 . . . . 65.409999999999997 110.223 178.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.95 -47.19 81.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.699 -0.682 . . . . 70.329999999999998 110.815 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -66.65 -29.22 69.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 72.349999999999994 110.246 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.55 -28.56 73.11 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 121.094 -0.574 . . . . 65.430000000000007 112.32 178.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -96.45 11.8 33.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.852 0.358 . . . . 74.409999999999997 110.504 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.9 t70 66.86 19.64 10.64 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.561 -0.745 . . . . 74.049999999999997 110.89 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.9 mt -84.46 113.35 23.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.267 -0.424 . . . . 74.219999999999999 109.985 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.26 120.74 23.9 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 115.915 -0.584 . . . . 63.030000000000001 112.431 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -109.27 136.33 48.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.78 0.324 . . . . 75.439999999999998 110.841 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -94.38 94.77 8.46 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.007 -0.738 . . . . 62.229999999999997 109.007 176.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.424 HG21 HG22 ' A' ' 70' ' ' VAL . 20.7 t . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.728 -0.669 . . . . 62.32 110.17 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.458 -0.562 0 CA-C-O 120.974 0.323 . . . . 75.519999999999996 111.262 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.601 ' HA ' ' NE ' ' A' ' 68' ' ' ARG . 2.6 mmp_? -92.9 136.22 33.45 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.228 -0.442 . . . . 74.040000000000006 111.234 -176.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.1 ptt180 -145.02 144.99 31.31 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.753 -0.658 . . . . 70.340000000000003 111.0 -178.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.424 HG22 HG21 ' A' ' 51' ' ' VAL . 53.7 t -105.71 127.42 60.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.906 -0.588 . . . . 73.329999999999998 110.245 179.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.535 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 7.6 mp -113.27 137.78 50.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.153 -0.476 . . . . 75.099999999999994 110.337 178.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.7 m -104.8 160.78 5.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.051 -0.522 . . . . 72.230000000000004 110.572 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.412 ' HA ' HD22 ' A' ' 23' ' ' LEU . 70.8 m-70 -84.47 40.81 0.8 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.512 -0.313 . . . . 75.319999999999993 111.585 -176.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 67.69 -173.2 0.19 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.806 -0.634 . . . . 63.509999999999998 112.401 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 27.2 t70 68.57 -70.76 0.13 Allowed 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 114.678 -1.146 . . . . 72.150000000000006 112.538 177.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.18 40.22 0.54 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.832 0.349 . . . . 71.219999999999999 111.746 -175.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.762 ' HG ' HH11 ' A' ' 24' ' ' ARG . 3.7 mm? -64.29 -49.98 69.69 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.737 -0.468 . . . . 63.32 109.737 175.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.72 -33.46 70.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.852 -0.613 . . . . 73.109999999999999 110.304 178.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.46 -52.48 48.81 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.891 -0.671 . . . . 71.239999999999995 112.138 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.42 86.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.472 0.177 . . . . 60.329999999999998 111.17 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -57.4 -48.82 78.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.487 -0.324 . . . . 64.010000000000005 111.352 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -67.51 -37.29 82.59 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 121.024 -0.27 . . . . 74.340000000000003 110.77 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 60.0 tp -60.62 -51.35 69.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.039 0.447 . . . . 73.109999999999999 110.52 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.603 HD21 HG12 ' A' ' 38' ' ' VAL . 10.5 mp -64.6 -33.79 76.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.907 -0.588 . . . . 73.329999999999998 111.326 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.837 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 95.3 m -66.92 -44.04 81.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.345 -0.389 . . . . 73.430000000000007 110.639 178.168 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -68.04 -35.29 78.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 74.430000000000007 110.136 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.57 -44.77 93.19 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.765 -0.652 . . . . 75.010000000000005 111.16 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 127.21 -14.78 6.52 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.228 -0.987 . . . . 73.230000000000004 113.602 175.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.484 HD12 ' HG ' ' A' ' 84' ' ' LEU . 1.6 pp -94.79 19.32 10.27 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.321 0.489 . . . . 64.310000000000002 112.321 -175.362 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.837 ' HB3' ' HA ' ' A' ' 85' ' ' THR . . . -68.63 84.54 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.94 0.4 . . . . 74.319999999999993 110.51 176.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -145.77 -48.05 0.22 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.839 -0.618 . . . . 74.040000000000006 109.883 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -79.87 -7.63 58.83 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.021 0.439 . . . . 72.140000000000001 110.543 -179.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.802 HD11 ' HA ' ' A' ' 90' ' ' ALA . 7.1 mp -67.09 134.83 52.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.891 -0.595 . . . . 73.030000000000001 110.094 178.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 . . . . . 0 C--N 1.323 -0.551 0 CA-C-O 121.094 0.473 . . . . 54.240000000000002 110.869 -177.217 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 120.769 0.319 . . . . 72.549999999999997 110.337 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 95.25 89.69 1.74 Allowed Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.915 -0.659 . . . . 64.209999999999994 111.594 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.3 m -70.36 104.7 2.78 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.026 0.441 . . . . 73.340000000000003 110.733 -178.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 p -120.15 129.53 54.18 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 116.002 -0.544 . . . . 70.25 111.174 -177.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -147.48 20.62 1.19 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.635 -0.712 . . . . 73.349999999999994 109.677 174.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.9 m80 -109.53 116.94 32.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.042 -0.981 . . . . 75.430000000000007 110.744 179.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -132.66 116.76 17.05 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.844 -0.798 . . . . 72.010000000000005 108.844 170.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -142.86 126.44 16.87 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.871 -0.604 . . . . 72.400000000000006 111.091 -169.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -176.91 154.76 1.15 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.956 -0.565 . . . . 74.409999999999997 110.217 174.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -153.31 89.12 1.33 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.19 0.519 . . . . 72.129999999999995 109.682 175.318 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.3 p -75.07 143.27 43.53 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.771 -0.649 . . . . 72.140000000000001 111.091 -175.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.4 m -144.78 96.33 2.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 74.099999999999994 110.231 178.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -177.72 127.52 1.19 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 121.011 -0.614 . . . . 62.409999999999997 111.675 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -151.22 -31.12 0.17 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.915 0.388 . . . . 75.540000000000006 110.642 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.335 -0.393 . . . . 70.400000000000006 110.042 178.511 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 N--CA 1.453 -0.292 0 CA-C-O 120.912 0.387 . . . . 71.519999999999996 110.524 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -113.66 144.42 42.94 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.705 -0.48 . . . . 72.140000000000001 109.705 175.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.519 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 80.3 tt0 -77.11 110.59 11.91 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.783 -1.191 . . . . 72.239999999999995 107.783 172.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.547 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -79.92 -52.62 7.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.941 -0.572 . . . . 62.539999999999999 110.075 -173.011 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.633 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 2.1 pt? -152.52 150.72 29.88 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.735 -0.666 . . . . 75.450000000000003 109.491 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.474 ' HD2' ' OE2' ' A' ' 25' ' ' GLU . 8.7 ptm85 -132.53 121.56 23.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.282 0.563 . . . . 72.230000000000004 110.206 176.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.8 t -119.25 168.87 10.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.507 -0.77 . . . . 73.129999999999995 110.625 -175.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -117.05 7.96 13.24 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.54 -0.541 . . . . 73.430000000000007 109.54 174.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -105.38 142.43 35.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.4 -0.818 . . . . 72.430000000000007 110.134 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.423 ' HA ' HD13 ' A' ' 35' ' ' LEU . . . -94.94 -24.4 16.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.453 -0.339 . . . . 74.340000000000003 111.63 -175.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.5 t -77.99 -36.37 21.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.142 0.496 . . . . 71.340000000000003 110.137 -176.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.6 tp -61.16 -34.61 75.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.589 -0.732 . . . . 75.310000000000002 110.304 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.729 HD11 ' HG3' ' A' ' 68' ' ' ARG . 87.7 mt -63.26 -35.45 80.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.88 -0.6 . . . . 64.450000000000003 110.885 178.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.0 m -68.29 -27.66 66.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.218 0.532 . . . . 75.340000000000003 110.632 178.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.18 -51.11 8.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.852 -0.613 . . . . 72.129999999999995 110.804 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.467 HG13 ' HA ' ' A' ' 35' ' ' LEU . 9.8 p -65.8 -34.26 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.25 -0.432 . . . . 72.219999999999999 110.514 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.21 -48.03 83.0 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 121.08 -0.581 . . . . 63.119999999999997 112.557 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.72 -25.26 67.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.107 0.48 . . . . 74.010000000000005 111.243 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.537 ' HB3' HD22 ' A' ' 83' ' ' LEU . 94.4 mt -75.6 -52.37 10.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.055 -0.52 . . . . 73.049999999999997 110.075 177.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.27 -49.15 75.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.748 -0.66 . . . . 75.129999999999995 111.104 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.488 ' CG ' ' HE2' ' A' ' 49' ' ' HIS . 25.9 m-20 -63.6 -28.17 69.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.396 -0.365 . . . . 71.040000000000006 110.803 -178.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -73.44 -18.56 79.41 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.799 -0.715 . . . . 54.539999999999999 112.573 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -114.41 15.43 17.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.707 0.262 . . . . 63.43 111.707 -176.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.9 t70 71.45 7.35 6.01 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.426 0.631 . . . . 73.129999999999995 111.544 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 58.5 mt -70.96 112.09 5.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.169 -0.469 . . . . 74.409999999999997 111.01 -176.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -64.68 130.95 37.22 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.844 -0.616 . . . . 51.219999999999999 112.015 177.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.488 ' HE2' ' CG ' ' A' ' 43' ' ' ASP . 19.6 p80 -138.41 147.35 43.25 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.708 0.289 . . . . 72.129999999999995 110.769 -177.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.472 HD11 ' HB2' ' A' ' 71' ' ' LEU . 77.3 mt -82.8 -65.92 0.95 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.092 -0.503 . . . . 74.099999999999994 110.996 176.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 54.5 t . . . . . 0 N--CA 1.466 0.372 0 CA-C-O 121.875 0.845 . . . . 63.32 110.602 -177.087 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo . . . . . 0 N--CA 1.465 -0.174 0 CA-C-O 120.799 0.25 . . . . 73.450000000000003 111.89 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.729 ' HG3' HD11 ' A' ' 35' ' ' LEU . 13.3 mmt85 -130.02 122.52 28.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.186 -0.301 . . . . 72.400000000000006 110.186 -177.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.722 ' HD3' HD13 ' A' ' 71' ' ' LEU . 1.8 ptp180 -112.66 136.44 52.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.196 0.522 . . . . 74.299999999999997 110.402 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 48.2 t -106.97 111.64 36.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.991 -0.55 . . . . 52.340000000000003 110.162 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.722 HD13 ' HD3' ' A' ' 69' ' ' ARG . 7.6 mp -104.62 139.78 38.97 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.34 -0.391 . . . . 75.409999999999997 110.253 177.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.8 m -130.27 168.68 22.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 O-C-N 123.73 0.644 . . . . 74.450000000000003 110.038 177.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 -82.38 163.22 21.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.292 -0.413 . . . . 74.120000000000005 110.83 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -59.45 -27.07 65.74 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.293 -0.412 . . . . 62.530000000000001 110.169 174.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -43.41 -59.12 2.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.218 -0.901 . . . . 74.5 111.781 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -116.79 35.42 4.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.181 -0.463 . . . . 74.340000000000003 110.31 -175.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.497 ' O ' ' HG3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -59.71 -53.89 52.69 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.363 -0.606 . . . . 73.120000000000005 109.363 178.675 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.48 -30.34 69.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.977 -0.556 . . . . 71.140000000000001 110.704 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.87 -49.32 49.36 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.802 -0.635 . . . . 62.32 112.389 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.75 -39.51 93.75 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.387 0.137 . . . . 62.399999999999999 110.71 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 77' ' ' LEU . 73.5 mtp180 -57.66 -47.92 80.94 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 110.088 -0.338 . . . . 73.129999999999995 110.088 175.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 82' ' ' ARG . 3.8 tpp180 -58.12 -50.9 71.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.79 -0.641 . . . . 73.219999999999999 110.494 178.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.537 HD22 ' HB3' ' A' ' 41' ' ' LEU . 55.7 tp -58.35 -52.18 66.69 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.529 -0.76 . . . . 75.209999999999994 111.856 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.98 -33.43 73.68 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.624 0.25 . . . . 73.420000000000002 111.643 -177.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.953 ' HA ' ' HB1' ' A' ' 90' ' ' ALA . 53.4 m -73.3 -36.67 66.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.1 0.476 . . . . 63.340000000000003 110.633 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -74.53 -32.79 62.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.83 -0.623 . . . . 74.209999999999994 110.3 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.57 96.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.776 -0.647 . . . . 72.5 111.807 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 150.94 -47.4 0.59 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 119.76 -1.21 . . . . 73.010000000000005 113.622 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.818 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -53.58 -75.77 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.7 0.25 . . . . 74.230000000000004 111.504 -175.014 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.953 ' HB1' ' HA ' ' A' ' 85' ' ' THR . . . 42.2 38.89 1.24 Allowed 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.573 0.582 . . . . 63.219999999999999 112.573 178.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 29.5 t-80 -132.78 -46.44 0.87 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.385 0.612 . . . . 73.510000000000005 110.375 -176.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -71.09 -13.25 61.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.038 -0.983 . . . . 73.030000000000001 110.892 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.633 ' HA ' ' HB3' ' A' ' 27' ' ' LEU . 6.7 mp -66.13 96.0 0.31 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.881 -0.6 . . . . 72.450000000000003 110.131 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.043 -0.526 . . . . 72.040000000000006 110.577 -172.702 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttt . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.169 0.509 . . . . 71.109999999999999 110.109 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -174.97 54.71 0.13 Allowed Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 110.865 -0.894 . . . . 64.340000000000003 110.865 178.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.4 p -90.77 -4.52 56.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.49 -0.355 . . . . 73.549999999999997 111.888 -173.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.2 p -76.35 71.86 3.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.114 0.483 . . . . 74.310000000000002 112.238 -175.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -163.35 121.22 1.92 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.139 0.495 . . . . 75.299999999999997 111.49 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -118.56 -113.81 0.33 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 107.434 -1.321 . . . . 74.329999999999998 107.434 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 62.91 28.44 16.34 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.174 0.512 . . . . 63.030000000000001 111.815 166.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -114.48 105.39 13.05 Favored 'General case' 0 C--N 1.329 -0.31 0 O-C-N 121.699 -0.626 . . . . 72.140000000000001 111.558 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.4 p80 -160.81 126.63 3.9 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.917 -0.401 . . . . 60.439999999999998 109.917 170.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.4 t-160 -160.31 70.08 0.41 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.226 0.536 . . . . 70.340000000000003 109.689 178.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 p -99.38 101.36 12.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.738 -0.664 . . . . 61.219999999999999 110.607 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.6 m -152.2 86.27 1.29 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.334 -0.394 . . . . 63.420000000000002 110.558 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -132.6 37.27 2.05 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.858 -0.687 . . . . 74.5 111.938 179.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -101.97 36.0 2.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.082 0.468 . . . . 75.030000000000001 110.218 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 . . . . . 0 C--N 1.324 -0.515 0 CA-C-N 115.754 -0.657 . . . . 70.230000000000004 110.458 179.819 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.44 ' HB3' HD23 ' A' ' 71' ' ' LEU . 95.3 mt . . . . . 0 C--O 1.236 0.382 0 CA-C-O 121.033 0.444 . . . . 62.030000000000001 111.555 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 50.3 mmm-85 -106.09 132.99 51.51 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.722 -0.672 . . . . 74.040000000000006 109.87 177.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.549 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 22.3 tt0 -80.31 110.69 15.99 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.291 -0.633 . . . . 74.200000000000003 109.291 -179.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.654 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -84.62 -55.0 4.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.051 -0.522 . . . . 71.140000000000001 110.667 -172.597 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.747 ' HB3' HD23 ' A' ' 93' ' ' LEU . 1.2 pt? -142.59 153.99 44.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.14 -0.482 . . . . 72.329999999999998 110.689 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -139.98 130.8 25.97 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.324 -0.853 . . . . 71.319999999999993 109.07 -178.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.0 t -167.11 175.5 7.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.118 -0.327 . . . . 60.439999999999998 110.118 178.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -119.53 4.07 11.17 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.368 -0.378 . . . . 64.319999999999993 110.202 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -85.6 108.27 17.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 64.239999999999995 110.353 -178.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.62 -35.91 81.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.728 -0.669 . . . . 75.430000000000007 111.52 -176.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 50.7 t -62.06 -51.95 66.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.911 0.386 . . . . 65.129999999999995 110.437 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.548 HD13 HD11 ' A' ' 89' ' ' LEU . 32.9 tp -64.45 -42.13 96.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.989 -0.55 . . . . 72.219999999999999 110.853 -179.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.1 mt -59.35 -38.95 81.69 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.778 0.323 . . . . 60.200000000000003 111.201 178.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 m -66.43 -38.72 88.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.918 0.39 . . . . 74.200000000000003 110.496 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.29 -46.52 80.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 63.329999999999998 110.288 177.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.543 HG13 HD21 ' A' ' 84' ' ' LEU . 95.5 t -59.59 -43.54 91.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 65.420000000000002 110.751 178.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.22 -43.68 97.01 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.985 -0.626 . . . . 74.219999999999999 111.918 178.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.47 -36.08 82.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.721 0.296 . . . . 71.430000000000007 110.886 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 94.2 mt -65.35 -52.29 54.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.004 0.431 . . . . 63.520000000000003 110.395 178.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.0 mt -64.53 -36.73 85.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.808 -0.633 . . . . 75.239999999999995 110.859 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -65.1 -39.96 93.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.029 -0.532 . . . . 72.109999999999999 110.305 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.61 -21.43 74.67 Favored Glycine 0 CA--C 1.518 0.239 0 CA-C-N 115.804 -0.635 . . . . 73.349999999999994 112.876 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -101.63 0.66 36.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.957 0.408 . . . . 65.430000000000007 110.338 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 t70 59.59 30.09 19.7 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.27 -0.877 . . . . 74.219999999999999 111.253 178.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 65.2 mt -79.67 114.83 21.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-N 115.962 -0.563 . . . . 72.319999999999993 110.158 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.21 110.87 2.71 Favored Glycine 0 N--CA 1.453 -0.195 0 CA-C-N 116.06 -0.518 . . . . 71.430000000000007 112.183 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 54.2 p-80 -131.36 137.86 48.92 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.71 0.29 . . . . 73.120000000000005 110.808 -175.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 92.8 mt -112.63 146.55 38.42 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.665 -0.495 . . . . 73.540000000000006 109.665 177.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.418 HG12 ' HA ' ' A' ' 70' ' ' VAL . 16.7 m . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 116.486 -0.325 . . . . 74.109999999999999 110.452 -176.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo . . . . . 0 C--O 1.234 0.32 0 CA-C-O 121.243 0.434 . . . . 52.409999999999997 111.656 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -105.58 112.48 25.58 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.647 -0.706 . . . . 74.510000000000005 110.212 -176.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.407 ' HG3' ' OE1' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -115.39 158.97 21.7 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.007 -0.542 . . . . 62.509999999999998 109.842 176.799 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.418 ' HA ' HG12 ' A' ' 51' ' ' VAL . 21.4 t -109.24 118.09 55.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.406 -0.361 . . . . 74.239999999999995 110.747 -175.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.549 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.3 mp -107.88 132.49 53.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.206 -0.452 . . . . 71.420000000000002 109.794 177.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.3 m -92.77 142.86 12.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 120.878 0.37 . . . . 64.349999999999994 110.738 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -88.18 61.2 6.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 74.230000000000004 110.477 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 55.85 -169.25 0.09 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.215 -0.902 . . . . 64.439999999999998 112.217 178.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.4 t70 64.32 -72.59 0.06 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.924 0.889 . . . . 71.239999999999995 112.328 177.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.598 ' OD1' ' HA3' ' A' ' 79' ' ' GLY . 0.4 OUTLIER -88.93 36.53 0.81 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.187 0.517 . . . . 73.019999999999996 110.577 -175.473 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.39 -51.18 70.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.617 -0.719 . . . . 75.310000000000002 110.419 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.41 -27.72 62.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.714 -0.675 . . . . 63.32 110.244 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.598 ' HA3' ' OD1' ' A' ' 76' ' ' ASP . . . -61.67 -52.87 47.94 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.649 -0.705 . . . . 72.120000000000005 112.424 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.96 97.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.629 0.252 . . . . 71.439999999999998 111.088 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 81.4 mtp180 -59.16 -41.85 89.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.094 0.473 . . . . 72.0 110.63 178.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.405 ' HE ' ' HA ' ' A' ' 82' ' ' ARG . 0.3 OUTLIER -68.89 -49.62 56.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.621 -0.718 . . . . 72.540000000000006 110.809 179.545 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 49.6 tp -56.27 -48.99 75.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.519 -0.764 . . . . 74.510000000000005 112.074 -173.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.543 HD21 HG13 ' A' ' 38' ' ' VAL . 11.1 mp -67.66 -27.37 66.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.651 -0.249 . . . . 74.019999999999996 111.211 -178.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.758 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.2 m -70.97 -43.48 67.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.396 -0.365 . . . . 74.239999999999995 110.264 175.114 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -62.77 -39.79 95.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.999 -0.546 . . . . 72.099999999999994 110.764 176.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.86 -43.47 85.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.801 -0.636 . . . . 75.409999999999997 111.465 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 140.08 -43.37 1.14 Allowed Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 119.939 -1.124 . . . . 73.200000000000003 113.433 176.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.881 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -58.93 -75.94 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.654 0.242 . . . . 74.219999999999999 111.654 -175.299 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.881 ' H ' ' HG ' ' A' ' 89' ' ' LEU . . . 44.69 44.46 7.49 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 122.772 0.429 . . . . 54.420000000000002 111.548 -177.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -116.55 -56.02 2.32 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.893 -0.323 . . . . 74.239999999999995 111.467 -173.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -76.81 10.25 2.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.299 -0.41 . . . . 73.120000000000005 111.235 -177.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.747 HD23 ' HB3' ' A' ' 27' ' ' LEU . 63.2 mt -80.52 117.8 21.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.433 . . . . 70.129999999999995 110.273 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 . . . . . 0 C--N 1.319 -0.757 0 N-CA-C 109.226 -0.657 . . . . 73.219999999999999 109.226 177.03 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttp . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.76 0.314 . . . . 62.240000000000002 110.542 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.24 86.59 1.86 Allowed Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.8 -0.714 . . . . 72.329999999999998 111.707 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.1 m -116.06 118.56 33.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.779 0.323 . . . . 55.399999999999999 110.844 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.6 m -104.39 114.07 28.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.638 -0.504 . . . . 43.329999999999998 109.638 176.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -137.84 105.78 5.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.238 0.542 . . . . 73.420000000000002 111.624 -176.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -142.99 95.0 2.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.45 -0.795 . . . . 73.310000000000002 109.802 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -75.14 149.52 39.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.467 -0.788 . . . . 75.519999999999996 110.904 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -167.91 128.94 1.41 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.218 0.532 . . . . 73.310000000000002 111.061 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.5 p-80 -145.22 75.92 1.46 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.795 0.807 . . . . 71.420000000000002 109.754 175.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -81.54 87.59 6.23 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.737 -0.665 . . . . 73.340000000000003 111.571 -171.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.1 m -130.67 123.57 29.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.851 -0.796 . . . . 72.25 108.851 173.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.3 t -135.92 104.31 5.68 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.484 0.55 . . . . 72.409999999999997 112.484 -175.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 72.37 -167.53 53.23 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.285 -0.871 . . . . 75.120000000000005 114.917 167.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -172.99 -176.62 1.44 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.508 -0.846 . . . . 65.530000000000001 108.981 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 . . . . . 0 C--N 1.325 -0.491 0 N-CA-C 110.354 -0.239 . . . . 75.329999999999998 110.354 177.475 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.544 HD23 HD11 ' A' ' 50' ' ' LEU . 5.8 mp . . . . . 0 CA--C 1.519 -0.226 0 N-CA-C 109.85 -0.426 . . . . 75.030000000000001 109.85 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -122.06 169.27 11.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.299 -0.41 . . . . 75.109999999999999 110.218 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -67.89 120.72 14.64 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.28 -0.418 . . . . 63.340000000000003 111.384 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.615 HD11 HD22 ' A' ' 27' ' ' LEU . 1.8 tm? -74.62 -36.41 62.94 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 107.254 -1.388 . . . . 64.319999999999993 107.254 169.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.615 HD22 HD11 ' A' ' 26' ' ' LEU . 2.5 pt? -176.81 159.99 1.84 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.186 -0.915 . . . . 71.540000000000006 110.195 -175.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.442 ' NH1' ' HB3' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -110.07 112.02 23.74 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.081 -1.081 . . . . 74.439999999999998 108.081 170.125 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.636 HG21 ' H ' ' A' ' 32' ' ' ALA . 11.2 m -85.13 109.22 18.11 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.104 -0.498 . . . . 74.439999999999998 111.237 -171.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.442 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.6 OUTLIER -90.51 -15.04 31.49 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.125 -0.694 . . . . 74.340000000000003 109.125 176.569 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -73.14 -32.48 64.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.12 -0.945 . . . . 71.430000000000007 110.873 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.636 ' H ' HG21 ' A' ' 29' ' ' THR . . . 74.25 -40.27 0.45 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.703 0.801 . . . . 73.299999999999997 112.586 178.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.1 t -78.91 -39.99 22.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.051 0.453 . . . . 75.319999999999993 110.805 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.5 tp -52.79 -39.84 62.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.681 -0.691 . . . . 63.119999999999997 112.266 -178.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 4.5 pp -65.23 -25.2 67.58 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 111.651 0.241 . . . . 73.019999999999996 111.651 -175.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.1 m -70.67 -34.03 71.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.099 0.476 . . . . 74.040000000000006 109.958 178.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.33 -40.91 50.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.974 -0.557 . . . . 73.25 110.044 176.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.46 HG11 HD22 ' A' ' 84' ' ' LEU . 75.1 t -57.24 -36.34 51.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 115.606 -0.725 . . . . 75.319999999999993 110.799 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.99 -46.03 95.41 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.596 -0.729 . . . . 70.439999999999998 112.433 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.34 -26.6 65.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.913 0.387 . . . . 72.409999999999997 111.201 -179.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.32 -52.12 13.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.395 -0.366 . . . . 74.230000000000004 110.977 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.527 HD21 HD21 ' A' ' 83' ' ' LEU . 63.7 mt -69.45 -39.45 77.76 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.218 -0.446 . . . . 75.239999999999995 111.401 -175.053 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -30.54 60.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.586 -0.279 . . . . 60.219999999999999 111.117 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.51 -26.67 73.6 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.038 -0.601 . . . . 72.200000000000003 111.796 177.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.45 5.58 46.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.597 0.237 . . . . 64.549999999999997 110.876 178.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.1 t70 70.61 7.68 6.3 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.84 -0.618 . . . . 74.030000000000001 111.217 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.0 mt -75.2 -45.36 41.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.254 0.549 . . . . 63.119999999999997 110.696 -178.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.01 148.21 23.86 Favored Glycine 0 C--N 1.315 -0.588 0 CA-C-N 115.285 -0.871 . . . . 54.25 111.854 -179.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -142.66 139.78 31.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.291 -0.263 . . . . 74.319999999999993 110.291 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.544 HD11 HD23 ' A' ' 23' ' ' LEU . 71.0 mt -119.02 106.73 12.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.826 0.346 . . . . 73.340000000000003 110.469 175.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.585 HG21 HG22 ' A' ' 70' ' ' VAL . 59.0 t . . . . . 0 C--N 1.325 -0.498 0 N-CA-C 109.046 -0.724 . . . . 75.349999999999994 109.046 174.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 N--CA 1.46 -0.448 0 CA-C-O 121.194 0.414 . . . . 75.340000000000003 111.464 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -72.58 133.55 44.77 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.707 -0.679 . . . . 64.109999999999999 110.223 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 57.2 mtt85 -113.97 135.1 54.37 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.999 -0.546 . . . . 72.329999999999998 111.765 -171.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.585 HG22 HG21 ' A' ' 51' ' ' VAL . 45.0 t -101.98 116.55 45.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.913 -0.585 . . . . 73.209999999999994 109.666 177.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mp -101.95 142.98 32.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.793 0.33 . . . . 75.430000000000007 110.546 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.415 HG21 ' HB2' ' A' ' 26' ' ' LEU . 3.0 t -126.29 154.25 35.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.9 -0.591 . . . . 45.109999999999999 109.882 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -59.14 139.06 57.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.99 -0.55 . . . . 73.540000000000006 109.637 174.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -57.53 156.43 8.16 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.969 -0.292 . . . . 71.310000000000002 110.387 178.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 28.7 t70 73.05 -47.5 0.67 Allowed 'General case' 0 N--CA 1.468 0.471 0 O-C-N 123.935 0.772 . . . . 54.530000000000001 110.376 -173.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -73.85 -16.13 61.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.787 -0.82 . . . . 74.409999999999997 108.787 175.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.417 HD23 HD23 ' A' ' 26' ' ' LEU . 1.1 tm? -55.57 -45.83 77.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.524 -1.216 . . . . 72.209999999999994 109.659 174.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.06 -38.16 89.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 74.420000000000002 110.987 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.62 -44.41 82.13 Favored Glycine 0 C--N 1.329 0.181 0 C-N-CA 120.971 -0.633 . . . . 70.049999999999997 111.829 177.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.54 -39.78 85.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.77 0.319 . . . . 63.340000000000003 110.683 177.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.4 mtp180 -55.35 -52.91 61.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.89 -0.596 . . . . 75.329999999999998 110.947 176.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -62.3 -43.49 98.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 75.329999999999998 110.754 -177.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.527 HD21 HD21 ' A' ' 42' ' ' LEU . 50.1 tp -59.28 -47.11 86.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.641 -0.708 . . . . 74.450000000000003 111.035 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.46 HD22 HG11 ' A' ' 38' ' ' VAL . 66.4 mt -72.01 -26.11 62.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.073 -0.512 . . . . 75.340000000000003 111.588 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 56.4 m -68.0 -48.3 66.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.584 -0.28 . . . . 75.040000000000006 110.423 176.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -65.64 -42.09 91.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.86 0.362 . . . . 73.439999999999998 110.698 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -119.42 82.21 1.84 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.099 0.476 . . . . 72.239999999999995 111.136 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 154.3 -95.69 0.15 Allowed Glycine 0 N--CA 1.44 -1.091 0 N-CA-C 111.384 -0.686 . . . . 34.130000000000003 111.384 178.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.568 HD12 ' N ' ' A' ' 90' ' ' ALA . 1.7 pp 175.12 -35.28 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.763 0.425 . . . . 64.140000000000001 110.662 -177.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ALA . . . . . 0.568 ' N ' HD12 ' A' ' 89' ' ' LEU . . . 48.39 54.12 10.9 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.707 -0.679 . . . . 61.299999999999997 112.185 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -99.8 -34.64 10.07 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.642 0.258 . . . . 75.5 110.879 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -82.09 24.44 0.65 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.344 -0.389 . . . . 71.0 111.786 -175.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.422 HD22 ' HB3' ' A' ' 90' ' ' ALA . 94.2 mt -50.09 117.51 2.38 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.372 0.42 . . . . 72.510000000000005 111.83 -175.084 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 . . . . . 0 N--CA 1.466 0.346 0 O-C-N 124.048 0.842 . . . . 74.329999999999998 110.947 -172.991 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.0 mtp . . . . . 0 N--CA 1.478 0.968 0 CA-C-O 120.714 0.293 . . . . 72.530000000000001 110.531 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 117.64 90.02 1.42 Allowed Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.821 -0.704 . . . . 61.420000000000002 111.968 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.6 p -66.61 158.08 30.81 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.884 0.374 . . . . 75.530000000000001 110.78 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 m -76.2 97.49 4.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.936 0.398 . . . . 75.319999999999993 110.722 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -90.33 93.64 9.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 65.420000000000002 109.899 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -123.02 99.27 6.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.181 -0.463 . . . . 72.510000000000005 110.11 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 74.9 m-70 -110.49 169.41 8.76 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.067 -0.716 . . . . 73.420000000000002 109.067 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -153.56 130.83 11.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.262 0.554 . . . . 74.310000000000002 111.097 178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -142.99 113.12 7.17 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.445 -0.798 . . . . 71.340000000000003 109.101 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -103.68 112.03 24.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.035 0.445 . . . . 73.310000000000002 110.652 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.1 m -150.65 117.94 6.02 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.714 -0.676 . . . . 71.349999999999994 110.406 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -134.68 88.7 2.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.078 -0.51 . . . . 74.120000000000005 109.928 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -131.67 58.0 0.71 Allowed Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 111.373 -0.691 . . . . 42.109999999999999 111.373 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.89 76.3 8.71 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.638 -0.504 . . . . 71.299999999999997 109.638 -176.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -97.66 -11.3 23.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.89 -0.595 . . . . 74.099999999999994 110.736 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -71.58 104.78 3.41 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.553 -0.536 . . . . 73.140000000000001 109.553 175.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 83.4 mt -100.19 1.51 42.04 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.132 -0.486 . . . . 75.340000000000003 111.246 -175.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.403 ' O ' ' HB2' ' A' ' 19' ' ' PHE . 47.2 m-85 -129.39 -159.69 0.98 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.557 0.217 . . . . 65.450000000000003 110.759 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' A' ' 18' ' ' TYR . 66.6 m-85 73.97 75.88 0.12 Allowed 'General case' 0 C--O 1.234 0.286 0 O-C-N 124.055 0.847 . . . . 75.430000000000007 111.84 176.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -91.91 93.5 8.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.448 -0.796 . . . . 64.430000000000007 109.666 171.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -176.75 -134.87 2.05 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 110.891 -0.883 . . . . 61.030000000000001 110.891 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER 177.67 -51.24 0.01 OUTLIER 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.848 0.324 . . . . 71.109999999999999 111.18 178.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.7 mt -134.82 143.38 47.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.028 0.442 . . . . 65.209999999999994 111.649 -175.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.876 ' HB2' HD22 ' A' ' 77' ' ' LEU . 50.7 mtt180 -134.4 148.03 50.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.974 -0.557 . . . . 72.439999999999998 109.729 173.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.838 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 25.1 tt0 -81.94 136.58 35.29 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.038 -0.528 . . . . 70.109999999999999 110.701 -177.11 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.668 HD11 HG22 ' A' ' 72' ' ' VAL . 11.2 mp -106.77 -65.86 1.06 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.634 0.254 . . . . 63.329999999999998 111.521 -179.12 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -147.0 177.21 9.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.733 0.301 . . . . 74.140000000000001 110.925 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.416 HH11 ' HD3' ' A' ' 28' ' ' ARG . 6.2 ptp180 -148.46 154.28 39.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.319 -0.4 . . . . 73.420000000000002 110.223 -178.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.448 HG23 HD23 ' A' ' 34' ' ' LEU . 12.2 t 178.29 163.61 0.7 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.377 0.423 . . . . 74.239999999999995 110.121 176.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -113.95 -0.17 14.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.009 0.433 . . . . 74.430000000000007 109.834 175.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -73.77 116.51 14.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.755 -0.657 . . . . 72.129999999999995 110.576 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.56 -33.8 74.48 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.55 -0.75 . . . . 63.240000000000002 112.239 -176.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 65.7 t -72.34 -47.53 52.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.818 0.342 . . . . 73.230000000000004 110.25 -178.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.448 HD23 HG23 ' A' ' 29' ' ' THR . 40.2 tp -61.38 -40.83 95.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 75.129999999999995 110.426 178.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.551 HD11 ' HD2' ' A' ' 68' ' ' ARG . 69.9 mt -65.26 -29.17 69.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.959 -0.564 . . . . 73.129999999999995 111.356 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.1 m -76.05 -39.08 56.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.715 0.293 . . . . 62.530000000000001 110.528 177.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.443 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -64.43 -53.89 41.33 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.194 -0.457 . . . . 73.150000000000006 110.935 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.8 t -60.53 -38.25 77.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.066 -0.515 . . . . 63.5 110.884 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.55 -48.39 82.14 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.897 -0.592 . . . . 70.299999999999997 111.918 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.63 -34.66 77.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.714 0.293 . . . . 62.109999999999999 111.629 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 96.2 mt -64.6 -51.48 62.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.14 -0.482 . . . . 75.030000000000001 110.639 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.13 -41.36 74.02 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.93 -0.577 . . . . 74.209999999999994 110.984 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.74 -39.44 91.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.899 -0.591 . . . . 74.120000000000005 110.821 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.0 -25.04 71.95 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.122 -0.561 . . . . 72.319999999999993 112.822 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -102.05 7.98 41.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.542 0.211 . . . . 74.540000000000006 111.412 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.8 t70 61.41 30.55 18.98 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.539 0.685 . . . . 74.140000000000001 110.903 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.578 HG22 ' HB3' ' A' ' 80' ' ' ALA . 72.0 mt -85.13 121.18 36.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.298 -0.41 . . . . 72.439999999999998 110.347 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -62.63 107.98 1.89 Allowed Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.5 -0.64 . . . . 75.049999999999997 111.5 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 72' ' ' VAL . 52.1 p-80 -126.72 166.65 16.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.91 0.386 . . . . 72.200000000000003 111.48 -173.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.5 tp -138.58 104.61 5.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.347 -0.842 . . . . 71.120000000000005 109.676 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.572 HG11 HG23 ' A' ' 70' ' ' VAL . 29.5 m -110.89 2.35 8.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.506 0.669 . . . . 62.140000000000001 110.141 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 32.2 tp -97.15 82.36 3.17 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.174 -0.921 . . . . 73.219999999999999 110.732 -173.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.467 ' HB2' ' HG2' ' A' ' 69' ' ' ARG . 34.8 t70 -82.6 -65.83 0.96 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.38 -0.97 . . . . 62.450000000000003 108.38 172.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -139.3 150.0 44.9 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.227 -1.027 . . . . 73.349999999999994 108.227 167.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -130.58 118.89 21.7 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.199 0.523 . . . . 72.299999999999997 111.088 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.442 ' HB2' HG13 ' A' ' 66' ' ' ILE . 28.0 ttt -76.41 147.28 38.1 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.624 -0.716 . . . . 70.519999999999996 109.61 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.8 m -60.55 151.79 27.78 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.996 0.427 . . . . 73.519999999999996 111.321 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.437 ' O ' HG13 ' A' ' 58' ' ' ILE . 11.2 tp -75.05 3.77 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-N 115.885 -0.598 . . . . 74.299999999999997 111.744 -173.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.31 84.08 6.72 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.053 -0.721 . . . . 73.310000000000002 109.053 177.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 50.58 93.56 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.808 0.843 . . . . 72.239999999999995 112.099 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -66.52 160.62 46.79 Favored Glycine 0 N--CA 1.452 -0.289 0 CA-C-N 115.681 -0.691 . . . . 73.030000000000001 112.958 -177.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.7 p -80.95 -174.72 4.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.971 0.415 . . . . 71.420000000000002 111.153 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.62 -38.02 15.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.37 -0.377 . . . . 63.310000000000002 110.69 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -169.92 43.42 0.2 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 119.951 -1.119 . . . . 52.109999999999999 113.126 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 97.4 t -89.44 -34.87 7.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.236 0.541 . . . . 61.509999999999998 110.697 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.442 HG13 ' HB2' ' A' ' 56' ' ' MET . 50.2 mm -117.85 98.27 51.46 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.976 -0.556 . . . . 71.219999999999999 111.023 -177.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -91.99 140.66 2.34 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.172 2.581 . . . . 71.239999999999995 112.08 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.551 ' HD2' HD11 ' A' ' 35' ' ' LEU . 66.3 mtt180 -104.39 160.61 14.77 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.121 -0.326 . . . . 71.439999999999998 110.121 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.467 ' HG2' ' HB2' ' A' ' 53' ' ' ASP . 17.8 ptt180 -133.68 140.8 47.27 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.64 -0.504 . . . . 72.129999999999995 109.64 176.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.572 HG23 HG11 ' A' ' 51' ' ' VAL . 48.5 t -103.63 116.38 47.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.907 -0.588 . . . . 60.0 111.253 -173.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.838 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.4 mp -117.84 162.14 18.59 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.107 -0.701 . . . . 75.019999999999996 109.107 173.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.668 HG22 HD11 ' A' ' 26' ' ' LEU . 35.2 m -137.34 167.41 23.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 120.824 0.345 . . . . 64.319999999999993 110.104 174.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -73.13 137.55 45.24 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.223 -0.658 . . . . 64.219999999999999 109.223 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.798 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 40.9 mt-10 -65.26 -11.15 38.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.657 0.265 . . . . 72.200000000000003 111.584 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -55.59 -39.25 70.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.605 0.717 . . . . 75.200000000000003 110.009 171.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -129.43 33.81 4.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.338 -0.846 . . . . 70.129999999999995 110.215 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.876 HD22 ' HB2' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -56.52 -57.08 13.9 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.656 -0.702 . . . . 74.530000000000001 110.415 -177.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.49 70.36 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.841 -0.618 . . . . 61.25 110.996 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -68.97 -46.77 58.24 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 121.183 -0.532 . . . . 73.140000000000001 112.659 -178.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.578 ' HB3' HG22 ' A' ' 47' ' ' ILE . . . -63.58 -44.4 94.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.739 0.304 . . . . 63.530000000000001 110.862 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 57.2 mtp85 -67.39 -33.32 74.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.443 . . . . 73.230000000000004 110.401 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -62.01 -47.29 85.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.829 -0.623 . . . . 73.329999999999998 109.788 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.5 tp -60.37 -53.19 60.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 75.329999999999998 110.981 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.47 -28.81 68.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.12 -0.491 . . . . 63.100000000000001 112.001 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.737 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 47.4 m -85.26 -48.66 8.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.812 0.339 . . . . 71.349999999999994 111.213 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -74.19 -43.88 55.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.223 -0.444 . . . . 73.329999999999998 111.9 -173.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.54 29.99 4.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.853 0.359 . . . . 64.129999999999995 111.662 -174.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -121.35 -80.0 0.56 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.182 -1.009 . . . . 71.209999999999994 112.306 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.459 HD13 ' N ' ' A' ' 90' ' ' ALA . 1.8 pp -167.58 -44.5 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.873 -0.163 . . . . 75.319999999999993 111.273 -177.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.737 ' HB3' ' HA ' ' A' ' 85' ' ' THR . . . 55.96 94.67 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.724 0.64 . . . . 73.519999999999996 111.704 -178.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -157.64 -64.96 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.523 -0.471 . . . . 72.120000000000005 111.234 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -87.52 16.87 5.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.211 -0.45 . . . . 74.450000000000003 111.824 -172.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 98.8 mt -73.72 126.17 29.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.131 0.491 . . . . 71.530000000000001 111.615 -175.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -117.02 166.64 11.96 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.468 -0.787 . . . . 61.030000000000001 109.152 178.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.7 p -106.82 175.16 5.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.551 0.215 . . . . 73.239999999999995 111.167 -177.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -83.92 72.5 10.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 122.112 0.958 . . . . 63.210000000000001 109.265 171.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 0.99 0 CA-C-N 114.918 -1.037 . . . . 54.229999999999997 111.281 -175.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.7 ttp . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 110.176 -0.305 . . . . 74.450000000000003 110.176 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.62 119.24 2.63 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.684 -0.769 . . . . 63.399999999999999 111.993 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.3 t -139.12 97.81 3.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.155 0.502 . . . . 72.25 109.693 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 t -89.78 85.47 6.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.331 -0.618 . . . . 64.239999999999995 109.331 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -131.51 70.77 1.46 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.558 0.694 . . . . 74.420000000000002 110.291 -177.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -125.93 87.54 2.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.641 0.734 . . . . 70.310000000000002 110.828 -178.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.6 p-80 -126.03 37.91 4.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.754 -0.657 . . . . 75.319999999999993 109.848 176.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -70.91 77.94 0.64 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.7 -0.852 . . . . 73.219999999999999 108.7 175.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 37.7 t-80 -122.19 107.85 12.63 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.408 -0.814 . . . . 72.109999999999999 109.694 -173.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -130.28 95.43 3.9 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.561 -0.533 . . . . 73.129999999999995 109.561 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.6 t -129.49 113.97 15.54 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.169 -0.469 . . . . 74.430000000000007 109.775 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.2 t -151.3 112.19 4.27 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.183 -0.462 . . . . 74.219999999999999 110.266 178.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 84.38 65.26 1.53 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.908 -0.663 . . . . 63.43 112.7 177.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.427 ' HD2' ' OD1' ' A' ' 76' ' ' ASP . 51.2 ttp85 -77.25 94.91 4.21 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.869 -0.789 . . . . 75.010000000000005 108.869 177.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.406 ' O ' ' HB3' ' A' ' 16' ' ' ASN . 36.8 tt0 -84.86 95.32 8.97 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.214 -0.448 . . . . 72.329999999999998 112.021 -171.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 15' ' ' GLU . 11.2 p30 176.47 143.47 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.073 -0.967 . . . . 63.43 109.437 171.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 95.8 mt -124.96 22.08 8.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.883 0.373 . . . . 55.43 110.501 178.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.639 ' O ' ' HA ' ' A' ' 75' ' ' ASP . 60.5 m-85 -91.77 149.47 21.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.951 -0.568 . . . . 64.310000000000002 111.398 -177.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.2 p90 -176.31 156.09 1.56 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.576 -0.898 . . . . 73.310000000000002 108.576 176.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -171.92 -65.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.046 0.388 . . . . 72.519999999999996 112.046 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.46 -114.56 1.45 Allowed Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.821 -0.704 . . . . 74.209999999999994 113.754 -168.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -141.66 -77.28 0.28 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.062 0.458 . . . . 75.310000000000002 110.672 -173.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.616 HD11 HD21 ' A' ' 50' ' ' LEU . 14.1 mt -151.86 132.26 13.76 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 73.299999999999997 110.084 -176.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.593 ' HB2' HD21 ' A' ' 77' ' ' LEU . 17.5 mmt180 -113.84 133.38 55.45 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.228 -0.442 . . . . 73.439999999999998 110.419 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.673 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 29.6 tt0 -64.83 109.06 1.94 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.721 -0.844 . . . . 71.030000000000001 108.721 175.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.7 tp -87.16 -54.81 4.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.425 -0.352 . . . . 74.099999999999994 110.811 -172.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.58 157.06 43.21 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.282 -0.417 . . . . 73.109999999999999 110.102 177.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.436 ' HG3' ' HB3' ' A' ' 69' ' ' ARG . 39.9 ttp180 -142.73 119.95 11.51 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.628 -0.508 . . . . 72.400000000000006 109.628 179.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -148.91 160.55 43.16 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.107 -0.331 . . . . 64.109999999999999 110.107 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -107.56 10.28 29.26 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.395 -0.366 . . . . 71.349999999999994 110.531 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -92.51 107.51 19.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.382 -0.372 . . . . 72.150000000000006 110.066 177.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.98 -27.15 68.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.953 -0.567 . . . . 72.219999999999999 111.896 -175.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 44.2 t -66.85 -50.91 60.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.861 0.362 . . . . 73.340000000000003 110.477 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.696 HD11 HD23 ' A' ' 89' ' ' LEU . 23.1 tp -64.27 -38.68 91.91 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.979 -0.555 . . . . 63.509999999999998 110.323 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.452 HD11 ' HD2' ' A' ' 68' ' ' ARG . 77.7 mt -61.25 -32.9 72.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.96 -0.564 . . . . 62.039999999999999 111.047 177.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -70.02 -39.27 75.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.905 0.383 . . . . 72.340000000000003 110.559 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.495 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.19 -52.8 52.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 73.129999999999995 110.459 178.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.511 HG11 HD22 ' A' ' 84' ' ' LEU . 86.3 t -60.12 -40.36 83.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.895 -0.593 . . . . 72.010000000000005 110.428 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 43' ' ' ASP . . . -61.7 -49.32 77.56 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.601 -0.727 . . . . 55.299999999999997 112.264 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.37 -31.53 72.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.699 0.285 . . . . 73.400000000000006 111.295 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.679 ' HB3' HD23 ' A' ' 83' ' ' LEU . 94.7 mt -64.61 -51.75 61.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.219 -0.446 . . . . 74.400000000000006 110.702 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.1 mt -71.94 -40.05 68.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.104 -0.498 . . . . 45.420000000000002 110.832 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 39' ' ' GLY . 0.8 OUTLIER -66.5 -35.98 81.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.125 0.488 . . . . 71.219999999999999 110.35 -177.379 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -73.14 -35.51 57.24 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.855 -0.688 . . . . 63.109999999999999 112.378 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.15 -1.0 57.02 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.501 0.185 . . . . 73.340000000000003 111.501 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.4 t70 71.24 28.16 3.07 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.753 0.658 . . . . 55.530000000000001 110.857 177.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -84.02 128.31 38.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.167 -0.47 . . . . 73.439999999999998 110.193 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.81 110.82 3.7 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.064 -0.588 . . . . 65.239999999999995 111.978 -177.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -109.21 130.85 55.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.013 0.435 . . . . 74.140000000000001 111.436 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.616 HD21 HD11 ' A' ' 23' ' ' LEU . 60.8 tp -98.39 102.8 14.65 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.89 -0.782 . . . . 75.439999999999998 108.89 171.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.424 HG11 HG22 ' A' ' 70' ' ' VAL . 6.4 m -127.23 162.0 33.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.127 -0.488 . . . . 75.099999999999994 110.553 -175.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.9 tt 68.06 102.05 0.05 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 124.122 0.889 . . . . 72.219999999999999 110.311 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -111.98 92.05 3.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.022 -0.536 . . . . 75.150000000000006 110.856 -177.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -177.02 169.01 2.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.483 -0.781 . . . . 75.519999999999996 109.604 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -98.77 132.48 44.1 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.636 -0.257 . . . . 74.209999999999994 110.356 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.1 mmt -67.57 104.48 1.6 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.23 0.538 . . . . 72.239999999999995 110.852 178.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.8 t -123.48 162.98 21.78 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.615 -0.72 . . . . 73.099999999999994 109.985 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.4 tp -76.66 -18.54 14.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.419 0.628 . . . . 63.450000000000003 109.454 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.414 HD21 ' HA ' ' A' ' 59' ' ' LEU . 1.6 tm? -75.27 106.78 6.97 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.638 -0.875 . . . . 70.150000000000006 108.638 176.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -56.86 -50.15 73.31 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.937 -0.574 . . . . 73.420000000000002 111.01 -175.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 173.97 155.8 12.55 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 121.026 -0.607 . . . . 73.230000000000004 111.894 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.7 p -113.64 -39.73 3.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.759 0.314 . . . . 75.349999999999994 110.173 177.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.5 tp -173.09 119.64 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.075 -0.511 . . . . 72.319999999999993 110.081 177.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 146.09 166.49 12.07 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.677 -0.773 . . . . 43.340000000000003 112.383 176.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 37.7 t -109.93 -26.42 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 109.717 -0.475 . . . . 72.209999999999994 109.717 177.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 47.9 mm 69.09 91.03 0.08 OUTLIER Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 115.106 -0.952 . . . . 72.400000000000006 110.633 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -69.24 99.98 0.73 Allowed 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 122.731 2.287 . . . . 70.109999999999999 111.092 178.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.452 ' HD2' HD11 ' A' ' 35' ' ' LEU . 27.7 ttm180 -66.8 122.69 18.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.036 -0.529 . . . . 75.25 110.289 -177.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.436 ' HB3' ' HG3' ' A' ' 28' ' ' ARG . 19.3 ptt180 -113.27 152.12 30.23 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.727 -0.669 . . . . 75.450000000000003 110.449 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.424 HG22 HG11 ' A' ' 51' ' ' VAL . 29.8 t -112.98 117.51 55.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.683 -0.689 . . . . 74.209999999999994 110.104 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.673 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 7.5 mp -107.86 137.7 45.4 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.013 -0.365 . . . . 71.150000000000006 110.013 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.457 HG22 HD23 ' A' ' 77' ' ' LEU . 14.5 m -132.39 166.07 30.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.143 -0.48 . . . . 71.540000000000006 110.338 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -76.07 156.56 33.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.434 -0.348 . . . . 74.010000000000005 110.451 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.634 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 57.7 mp0 -59.97 -21.89 61.8 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.324 -0.398 . . . . 73.450000000000003 110.908 174.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.639 ' HA ' ' O ' ' A' ' 18' ' ' TYR . 1.4 m-20 -52.19 -71.41 0.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.854 -0.612 . . . . 74.400000000000006 110.737 176.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.427 ' OD1' ' HD2' ' A' ' 14' ' ' ARG . 44.5 m-20 -91.38 18.0 7.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.657 -0.701 . . . . 64.329999999999998 110.653 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.634 ' HB2' ' HA ' ' A' ' 74' ' ' GLU . 0.3 OUTLIER -56.87 -51.18 70.07 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.559 -0.534 . . . . 74.400000000000006 109.559 179.242 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.59 -32.48 72.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.602 -0.727 . . . . 62.130000000000003 110.991 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.42 -45.96 43.94 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.069 -0.586 . . . . 74.430000000000007 112.334 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.6 -40.21 95.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.59 0.233 . . . . 62.409999999999997 110.558 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -59.13 -45.03 91.99 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.847 0.356 . . . . 70.040000000000006 110.132 175.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.47 -50.9 72.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.779 -0.646 . . . . 74.099999999999994 110.553 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.679 HD23 ' HB3' ' A' ' 41' ' ' LEU . 55.8 tp -58.61 -52.96 63.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.772 -0.649 . . . . 71.230000000000004 111.257 -177.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.511 HD22 HG11 ' A' ' 38' ' ' VAL . 85.6 mt -66.54 -28.26 68.4 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.226 -0.443 . . . . 74.109999999999999 111.944 -177.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.859 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 90.6 m -82.45 -50.18 9.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.826 0.346 . . . . 64.450000000000003 111.14 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -72.93 -44.13 61.56 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.338 0.495 . . . . 75.310000000000002 112.338 -173.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -121.76 7.26 9.93 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.827 0.677 . . . . 73.209999999999994 112.827 -172.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -111.41 -74.96 0.76 Allowed Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 119.915 -1.136 . . . . 74.150000000000006 112.288 -178.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.696 HD23 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -172.61 -51.89 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.526 0.203 . . . . 74.299999999999997 111.203 -172.357 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.859 ' HB3' ' HA ' ' A' ' 85' ' ' THR . . . 59.2 82.98 0.14 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.905 -0.589 . . . . 54.43 110.74 -172.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -158.79 -44.59 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.03 0.443 . . . . 74.109999999999999 110.796 -176.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -89.91 11.11 21.35 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.071 -0.513 . . . . 71.120000000000005 110.819 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 90.9 mt -71.17 133.0 45.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 63.109999999999999 110.911 -176.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.437 ' HG3' ' O ' ' A' ' 95' ' ' SER . 3.4 tpt180 -116.79 -60.36 1.86 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.798 -0.637 . . . . 73.510000000000005 110.679 178.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.437 ' O ' ' HG3' ' A' ' 94' ' ' ARG . 19.4 m 64.3 -167.19 0.22 Allowed 'General case' 0 CA--C 1.535 0.387 0 O-C-N 123.372 0.42 . . . . 51.229999999999997 110.287 -176.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . 0.426 ' O ' ' HB2' ' A' ' 97' ' ' ASP . 15.4 p-10 -73.6 -53.08 11.33 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.594 -0.521 . . . . 74.349999999999994 109.594 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 96' ' ' ASP . 19.0 t70 . . . . . 0 C--O 1.251 1.157 0 O-C-N 124.131 0.894 . . . . 74.140000000000001 109.09 171.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.835 0.35 . . . . 53.109999999999999 110.207 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 81.3 -172.4 53.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.751 -0.738 . . . . 52.420000000000002 111.783 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.0 p -141.08 148.28 39.92 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.005 0.402 . . . . 72.439999999999998 110.784 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.2 p -87.0 133.19 33.6 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.041 -0.527 . . . . 71.209999999999994 110.563 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -124.34 116.26 22.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.512 0.672 . . . . 72.519999999999996 111.231 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -145.33 106.57 4.19 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.289 -0.869 . . . . 63.549999999999997 109.715 175.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -127.75 107.25 9.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.488 -0.324 . . . . 73.230000000000004 111.26 -176.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -144.27 146.45 32.64 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.401 -0.592 . . . . 71.010000000000005 109.401 172.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -156.02 118.42 4.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.131 0.491 . . . . 73.450000000000003 111.673 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -145.45 94.17 2.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.74 0.781 . . . . 70.319999999999993 109.923 168.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.1 t -130.65 102.18 6.01 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.356 -0.838 . . . . 64.219999999999999 109.493 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.7 t -149.35 155.34 40.35 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.485 -0.561 . . . . 64.230000000000004 109.485 -176.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 158.97 99.1 0.15 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.909 -0.663 . . . . 74.030000000000001 111.881 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -95.24 -26.91 15.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.917 0.389 . . . . 75.019999999999996 110.487 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -85.02 96.01 9.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.222 0.534 . . . . 72.239999999999995 110.326 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -144.14 168.78 19.22 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.178 -0.919 . . . . 73.450000000000003 108.951 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.8 mt -111.85 108.95 18.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.885 0.374 . . . . 63.020000000000003 110.885 -179.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -87.25 -28.52 22.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.268 -0.423 . . . . 72.010000000000005 110.284 175.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -69.09 157.8 36.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.026 -0.534 . . . . 75.319999999999993 110.96 -177.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -123.98 124.88 43.55 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.316 -0.402 . . . . 74.200000000000003 110.718 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -118.59 -167.6 13.97 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.57 -0.612 . . . . 54.530000000000001 111.57 176.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.43 ' O ' ' HB2' ' A' ' 74' ' ' GLU . 52.5 m80 -135.32 178.11 7.29 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.993 -0.373 . . . . 73.040000000000006 109.993 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.5 ' HA ' ' HA ' ' A' ' 73' ' ' HIS . 8.5 mp -80.62 129.28 34.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.057 -0.72 . . . . 73.129999999999995 109.057 174.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -105.3 142.52 34.93 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.407 -0.361 . . . . 73.140000000000001 110.229 -177.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.782 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 28.9 tt0 -76.12 109.07 9.48 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.472 -0.936 . . . . 75.329999999999998 108.472 176.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.82 -70.17 0.56 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.131 -0.486 . . . . 75.400000000000006 112.04 -169.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' A' ' 92' ' ' GLU . 0.9 OUTLIER -142.38 170.28 15.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.192 0.52 . . . . 74.340000000000003 112.225 -169.645 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.554 ' O ' ' HB3' ' A' ' 92' ' ' GLU . 6.4 ptp180 -138.34 158.04 45.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.881 -1.054 . . . . 73.530000000000001 109.0 177.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.8 t -161.21 163.03 31.4 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.05 -0.352 . . . . 62.32 110.05 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -116.02 11.41 15.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.141 -0.481 . . . . 75.129999999999995 110.363 -174.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -120.41 135.51 55.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.168 -0.469 . . . . 72.109999999999999 111.223 -177.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.21 -31.78 64.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.82 -0.627 . . . . 65.430000000000007 111.522 -176.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.4 t -69.87 -43.43 79.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.621 -0.511 . . . . 71.450000000000003 109.621 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.2 mp -58.84 -48.35 81.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.571 -0.741 . . . . 72.109999999999999 110.846 175.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.6 mt -52.79 -41.72 64.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.929 -0.578 . . . . 75.299999999999997 111.381 175.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.9 m -72.71 -41.63 65.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.226 -0.443 . . . . 65.409999999999997 111.092 -178.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.481 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -64.05 -54.22 37.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.481 -0.327 . . . . 51.119999999999997 110.649 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.677 HG11 HD23 ' A' ' 84' ' ' LEU . 87.8 t -61.02 -40.46 85.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.147 0.499 . . . . 75.319999999999993 110.607 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.17 -52.04 50.43 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 115.702 -0.681 . . . . 71.019999999999996 112.528 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.33 -31.8 67.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.671 0.272 . . . . 61.219999999999999 111.485 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 94.2 mt -63.15 -51.24 67.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.334 -0.394 . . . . 61.350000000000001 110.341 177.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.4 mt -68.25 -36.8 80.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.836 -0.62 . . . . 73.439999999999998 110.652 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -64.4 -46.84 81.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 72.329999999999998 110.53 177.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.47 -36.97 93.25 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.794 -0.639 . . . . 62.509999999999998 112.93 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.97 -10.72 59.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.012 0.434 . . . . 74.519999999999996 110.81 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.4 t70 70.32 23.71 4.96 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 115.061 -0.972 . . . . 73.340000000000003 110.635 178.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.9 mt -74.32 -39.34 48.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.701 -0.682 . . . . 71.140000000000001 109.485 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.19 110.68 0.33 Allowed Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 114.928 -1.033 . . . . 70.209999999999994 112.077 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -91.71 150.79 20.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.826 0.346 . . . . 63.020000000000003 110.884 -177.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.4 tp -114.09 87.31 2.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.785 -0.82 . . . . 71.129999999999995 108.785 170.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.679 HG13 HG23 ' A' ' 70' ' ' VAL . 6.3 m -96.49 56.32 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.521 0.677 . . . . 62.009999999999998 110.892 -176.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 97.6 mt -116.35 133.67 55.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.4 -0.818 . . . . 71.319999999999993 110.295 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -144.3 -64.47 0.36 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.507 -0.553 . . . . 64.439999999999998 109.507 174.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -157.42 133.72 9.67 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.993 -0.743 . . . . 75.530000000000001 108.993 175.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -83.14 140.96 32.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.823 0.344 . . . . 71.140000000000001 110.368 -177.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -76.43 134.02 39.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.264 -0.425 . . . . 75.109999999999999 110.455 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.5 m -83.9 135.9 34.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.349 -0.387 . . . . 61.219999999999999 110.508 177.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.6 tt -82.97 94.0 3.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.689 0.757 . . . . 72.519999999999996 110.481 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 57.0 tp -136.22 121.13 18.68 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.395 -0.82 . . . . 64.340000000000003 109.947 -179.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 57.46 43.78 22.41 Favored 'General case' 0 C--O 1.235 0.295 0 O-C-N 123.758 0.661 . . . . 61.229999999999997 110.973 -178.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 116.26 -105.95 1.44 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.792 -0.64 . . . . 72.25 112.078 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.4 t -170.25 56.83 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.195 0.521 . . . . 34.130000000000003 109.825 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.0 mp -108.37 104.29 13.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.238 -0.437 . . . . 64.209999999999994 110.692 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -139.0 98.07 0.24 Allowed Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.531 -0.628 . . . . 64.219999999999999 111.531 177.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 23.8 t -82.0 77.63 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.335 0.588 . . . . 75.019999999999996 110.833 -176.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.6 mp -128.4 117.92 20.16 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.338 -0.846 . . . . 70.319999999999993 109.335 174.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -71.95 113.91 3.81 Favored 'Trans proline' 0 C--O 1.234 0.321 0 C-N-CA 122.778 2.319 . . . . 74.400000000000006 111.854 178.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -69.0 139.81 55.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.321 -0.4 . . . . 74.230000000000004 110.222 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 63.2 mtt180 -114.1 155.22 26.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.198 -0.455 . . . . 74.299999999999997 110.275 -176.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.679 HG23 HG13 ' A' ' 51' ' ' VAL . 31.6 t -113.02 120.83 64.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.254 -0.43 . . . . 72.420000000000002 110.356 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.782 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.8 mp -114.89 143.52 45.0 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.609 0.242 . . . . 75.430000000000007 110.826 177.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.0 m -142.35 160.84 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 116.179 -0.464 . . . . 74.230000000000004 110.112 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 23' ' ' LEU . 2.0 p-80 -72.48 143.3 48.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.149 0.499 . . . . 74.310000000000002 111.255 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.857 ' HA ' HD23 ' A' ' 77' ' ' LEU . 31.1 tt0 -57.1 -37.01 71.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.056 -0.974 . . . . 63.229999999999997 113.059 -169.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -64.17 -18.95 64.96 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.33 0.492 . . . . 63.020000000000003 112.33 -171.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -117.12 15.22 15.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.019 0.438 . . . . 73.299999999999997 110.869 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.857 HD23 ' HA ' ' A' ' 74' ' ' GLU . 0.6 OUTLIER -58.96 -41.12 86.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.744 -0.662 . . . . 54.43 110.451 177.383 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.07 -40.33 80.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.913 -0.585 . . . . 75.219999999999999 111.187 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.91 -47.3 25.73 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.58 -0.819 . . . . 75.129999999999995 112.268 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.448 ' O ' ' HG ' ' A' ' 84' ' ' LEU . . . -63.07 -41.82 99.53 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.717 0.266 . . . . 65.549999999999997 111.717 -177.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -58.84 -47.75 83.76 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 120.574 0.226 . . . . 75.510000000000005 110.887 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -56.52 -45.15 81.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.2 0.524 . . . . 75.209999999999994 110.372 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 45.1 tp -64.9 -52.04 58.64 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.474 -0.785 . . . . 74.430000000000007 111.256 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.677 HD23 HG11 ' A' ' 38' ' ' VAL . 76.2 mt -70.41 -28.05 64.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.114 -0.494 . . . . 73.450000000000003 111.883 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.868 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.8 m -75.5 -49.49 18.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.645 0.26 . . . . 54.140000000000001 110.755 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -75.34 -44.15 46.81 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.042 0.386 . . . . 73.430000000000007 112.042 -174.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -115.04 20.15 15.24 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.152 0.427 . . . . 73.340000000000003 112.152 -173.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -125.84 -80.51 0.38 Allowed Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 120.176 -1.011 . . . . 73.219999999999999 111.527 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.626 HD12 ' N ' ' A' ' 90' ' ' ALA . 0.9 OUTLIER 176.77 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.763 0.425 . . . . 73.340000000000003 111.302 -176.827 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.868 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 65.12 7.05 3.83 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.165 0.802 . . . . 75.129999999999995 113.165 177.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -85.49 -33.95 21.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.923 0.392 . . . . 64.400000000000006 110.941 -177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.554 ' HB3' ' O ' ' A' ' 28' ' ' ARG . 5.7 mm-40 -80.85 1.17 31.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.716 -0.674 . . . . 75.219999999999999 111.161 -174.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 83.7 mt -66.6 115.37 6.38 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.232 -0.44 . . . . 65.540000000000006 111.62 -174.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.3 ttt180 72.05 -58.22 0.59 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 114.916 -1.038 . . . . 75.349999999999994 111.879 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 63.7 p -126.9 167.81 15.34 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.96 0.41 . . . . 72.25 110.87 -178.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -96.96 19.3 12.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.642 0.734 . . . . 74.530000000000001 109.608 176.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 30.8 t70 . . . . . 0 C--O 1.246 0.883 0 CA-C-N 115.25 -0.886 . . . . 75.430000000000007 110.658 -176.021 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 120.768 0.318 . . . . 70.120000000000005 110.46 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.12 113.89 0.31 Allowed Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.028 -0.606 . . . . 43.439999999999998 111.824 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.4 m -108.18 152.75 24.15 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.418 -0.586 . . . . 71.109999999999999 109.418 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.5 m -77.08 85.93 3.57 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.183 0.516 . . . . 64.120000000000005 110.103 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -89.43 73.42 7.89 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.668 0.747 . . . . 73.230000000000004 110.022 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -145.72 145.16 30.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.262 -0.881 . . . . 75.540000000000006 109.792 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -131.04 114.92 15.78 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.975 -0.557 . . . . 63.450000000000003 109.837 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -79.14 144.73 34.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.863 0.363 . . . . 74.120000000000005 110.527 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -159.53 122.58 3.6 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.459 -0.571 . . . . 75.040000000000006 109.459 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -117.67 114.31 23.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.078 0.466 . . . . 75.109999999999999 110.361 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.9 m -152.52 85.8 1.26 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.616 -0.72 . . . . 72.430000000000007 109.676 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.9 t -162.81 150.85 13.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.768 -0.651 . . . . 50.439999999999998 109.56 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 149.66 149.99 5.14 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.821 -0.704 . . . . 64.030000000000001 112.11 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 70.1 mtp180 -134.92 -175.52 3.93 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.626 0.25 . . . . 75.439999999999998 110.334 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -127.45 101.61 6.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.029 -0.532 . . . . 64.340000000000003 109.944 175.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -76.9 90.52 3.52 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.614 -0.884 . . . . 72.230000000000004 108.614 176.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 17' ' ' LEU . 1.6 tm? -101.12 100.55 11.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.091 -0.504 . . . . 74.400000000000006 110.367 -175.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -150.99 81.97 1.33 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.257 -0.883 . . . . 75.219999999999999 109.057 175.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -98.95 115.55 29.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.457 -0.792 . . . . 73.510000000000005 109.401 179.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -149.48 137.17 20.25 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.301 -0.629 . . . . 75.040000000000006 109.301 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -130.34 42.19 1.44 Allowed Glycine 0 C--N 1.329 0.162 0 C-N-CA 120.04 -1.076 . . . . 72.120000000000005 113.89 -170.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 20.9 m170 -106.7 172.69 6.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.908 0.385 . . . . 72.510000000000005 110.607 173.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.548 ' HG ' ' HD2' ' A' ' 73' ' ' HIS . 5.1 mp -117.2 142.77 46.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.041 -0.527 . . . . 75.230000000000004 110.285 -178.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.443 ' HB2' HD22 ' A' ' 77' ' ' LEU . 28.4 mmm-85 -133.35 133.84 43.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.039 -0.528 . . . . 74.310000000000002 110.149 -176.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.558 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 71.8 tt0 -68.59 114.74 7.24 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.529 -0.545 . . . . 74.150000000000006 109.529 173.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.491 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -84.72 -54.7 4.53 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.705 -0.48 . . . . 74.319999999999993 109.705 -175.89 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.555 HD12 HG21 ' A' ' 38' ' ' VAL . 2.1 pt? -148.27 160.7 42.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.149 0.5 . . . . 64.030000000000001 110.956 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.493 ' HG3' ' HG2' ' A' ' 69' ' ' ARG . 51.6 ttt180 -141.23 122.7 15.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.469 -0.787 . . . . 74.340000000000003 109.58 -178.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 t -150.26 177.81 9.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.675 0.274 . . . . 74.530000000000001 110.296 -177.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -124.67 -4.03 7.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.126 -0.488 . . . . 71.519999999999996 110.903 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -85.49 125.12 32.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.939 0.4 . . . . 75.219999999999999 110.769 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.6 -41.07 80.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.628 -0.715 . . . . 74.549999999999997 111.677 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.2 t -63.36 -43.26 98.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-O 121.277 0.561 . . . . 73.329999999999998 110.819 -176.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.514 ' CD2' ' HG3' ' A' ' 92' ' ' GLU . 47.6 tp -62.3 -44.46 96.47 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.791 -0.64 . . . . 54.119999999999997 110.798 178.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 68.2 mt -59.41 -39.56 83.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 75.150000000000006 111.266 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.7 m -62.47 -38.72 90.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.837 0.351 . . . . 70.230000000000004 110.958 178.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.444 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -66.83 -48.72 68.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 71.239999999999995 110.634 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.555 HG21 HD12 ' A' ' 27' ' ' LEU . 60.4 t -61.32 -39.92 84.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.971 -0.559 . . . . 72.420000000000002 110.6 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.64 -45.59 95.4 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.109 -0.567 . . . . 64.420000000000002 112.46 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.63 -28.98 69.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.904 0.383 . . . . 75.140000000000001 111.388 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 93.3 mt -73.6 -51.47 16.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.141 -0.481 . . . . 63.049999999999997 110.333 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.0 mt -66.66 -39.36 88.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.784 -0.644 . . . . 70.530000000000001 111.11 -176.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -70.18 -36.87 74.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.779 0.323 . . . . 72.310000000000002 110.784 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.45 -32.26 78.7 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.689 -0.767 . . . . 73.450000000000003 112.526 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.409 ' HB2' HG13 ' A' ' 47' ' ' ILE . . . -93.06 11.78 26.43 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.504 0.192 . . . . 72.040000000000006 111.466 -178.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.7 t70 59.26 30.15 19.84 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 122.016 0.912 . . . . 71.329999999999998 110.812 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.409 HG13 ' HB2' ' A' ' 45' ' ' ALA . 60.3 mt -83.97 -44.7 18.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.685 -0.688 . . . . 72.010000000000005 109.791 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.1 139.34 5.85 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.036 -0.983 . . . . 71.349999999999994 111.253 -175.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -123.75 117.14 24.26 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.101 0.477 . . . . 71.120000000000005 110.628 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.8 mt -101.71 96.51 7.14 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.781 -0.451 . . . . 74.319999999999993 109.781 176.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.696 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 30.6 m -101.41 -38.79 6.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.097 -0.501 . . . . 64.540000000000006 110.228 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.691 ' HG ' ' HB2' ' A' ' 54' ' ' GLN . 29.8 tp 64.56 119.42 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 O-C-N 124.35 1.031 . . . . 75.409999999999997 111.935 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.498 ' HA ' ' HE ' ' A' ' 68' ' ' ARG . 30.7 t70 -60.55 -58.24 9.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.703 . . . . 61.149999999999999 109.66 175.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.691 ' HB2' ' HG ' ' A' ' 52' ' ' LEU . 32.3 tt0 42.66 59.49 2.76 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.221 0.951 . . . . 75.209999999999994 111.94 175.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -85.57 76.16 10.05 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.33 0.586 . . . . 64.400000000000006 109.43 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 89.2 mtp -91.9 -54.12 3.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.389 -0.823 . . . . 74.340000000000003 109.984 -178.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.8 m -84.87 76.34 10.25 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.796 -0.638 . . . . 54.009999999999998 109.806 177.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 4.3 tp -77.36 92.39 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-O 121.797 0.808 . . . . 71.010000000000005 109.833 178.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.433 ' O ' ' HA2' ' A' ' 64' ' ' GLY . 1.7 tm? -131.93 104.02 6.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.95 -1.023 . . . . 73.209999999999994 108.895 178.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.33 -77.5 0.08 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.562 -0.744 . . . . 75.0 110.927 -177.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.34 -76.95 0.47 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.82 -0.705 . . . . 23.52 112.213 -176.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 36.5 m -124.23 -50.68 1.78 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.222 0.534 . . . . 72.140000000000001 110.303 176.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -121.26 -36.88 3.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.997 -0.547 . . . . 61.399999999999999 111.426 -175.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.433 ' HA2' ' O ' ' A' ' 59' ' ' LEU . . . 83.78 71.91 1.3 Allowed Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 109.951 -1.259 . . . . 73.319999999999993 109.951 -169.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.4 t -83.24 95.06 3.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.126 0.489 . . . . 71.530000000000001 112.18 -169.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.6 mp -104.73 99.57 19.19 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.636 -0.876 . . . . 72.019999999999996 108.636 168.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -71.76 106.67 2.03 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.765 2.31 . . . . 75.329999999999998 111.941 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.498 ' HE ' ' HA ' ' A' ' 53' ' ' ASP . 81.5 mtt85 -87.72 133.43 33.85 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.563 -0.532 . . . . 70.099999999999994 109.563 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.696 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 60.1 mtp180 -120.03 137.94 53.8 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.779 -0.646 . . . . 70.439999999999998 109.722 -169.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.65 HG22 HG13 ' A' ' 51' ' ' VAL . 8.1 t -99.95 105.94 18.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.823 0.344 . . . . 74.209999999999994 110.728 -171.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.558 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 9.1 mp -104.2 127.7 51.84 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.126 -0.488 . . . . 60.32 110.58 177.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 29.7 m -109.56 -176.04 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.602 -0.726 . . . . 72.239999999999995 109.648 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.548 ' HD2' ' HG ' ' A' ' 23' ' ' LEU . 43.1 m80 -107.22 162.37 13.94 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.938 -0.305 . . . . 63.140000000000001 110.267 -179.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -59.48 -22.73 62.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.407 0.622 . . . . 75.200000000000003 109.978 173.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -50.25 -36.18 30.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.477 -1.238 . . . . 51.420000000000002 112.684 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -141.49 30.59 1.72 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.853 0.358 . . . . 72.109999999999999 110.605 -175.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.443 HD22 ' HB2' ' A' ' 24' ' ' ARG . 0.2 OUTLIER -57.95 -47.4 83.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.05 0.453 . . . . 65.5 110.593 -177.081 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.29 -40.49 74.23 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.003 -0.544 . . . . 74.049999999999997 111.129 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -66.39 -48.21 65.19 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.903 -0.665 . . . . 74.239999999999995 112.157 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.71 -41.2 77.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.764 0.316 . . . . 71.450000000000003 110.815 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -59.12 -53.98 52.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.353 -0.385 . . . . 72.239999999999995 111.078 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -64.73 -38.21 90.2 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 121.175 -0.21 . . . . 71.409999999999997 111.265 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.3 tp -58.69 -47.98 82.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.077 0.465 . . . . 72.239999999999995 110.708 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.56 ' HG ' HD11 ' A' ' 89' ' ' LEU . 11.1 mp -72.89 -28.67 62.62 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.056 -0.52 . . . . 73.400000000000006 111.213 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.686 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 89.5 m -66.36 -46.14 77.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 110.358 -0.238 . . . . 43.43 110.358 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.62 -31.74 72.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.274 -0.421 . . . . 73.409999999999997 110.72 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.96 -27.06 67.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.067 0.461 . . . . 32.450000000000003 111.115 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.73 -15.83 59.27 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.801 -0.714 . . . . 73.109999999999999 112.493 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.56 HD11 ' HG ' ' A' ' 84' ' ' LEU . 3.2 pp -84.55 9.42 13.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.766 0.317 . . . . 73.200000000000003 111.366 -177.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.686 ' HB3' ' HA ' ' A' ' 85' ' ' THR . . . -65.65 86.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.131 0.491 . . . . 65.230000000000004 110.039 174.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -163.77 -37.23 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.4 -0.818 . . . . 71.109999999999999 110.009 -177.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.514 ' HG3' ' CD2' ' A' ' 34' ' ' LEU . 20.8 mm-40 -80.44 4.13 19.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.319 -0.401 . . . . 62.119999999999997 110.91 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.445 HD11 ' HA ' ' A' ' 90' ' ' ALA . 10.2 mp -65.61 142.85 57.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.058 -0.519 . . . . 72.310000000000002 111.16 -177.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -118.52 71.6 0.85 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.935 -0.575 . . . . 73.439999999999998 110.008 177.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.1 p -81.8 31.29 0.36 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.58 -0.736 . . . . 71.430000000000007 111.299 -176.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -88.36 7.35 32.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.054 -0.521 . . . . 74.140000000000001 110.587 -176.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.459 -0.781 . . . . 64.409999999999997 109.754 177.536 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 120.979 0.418 . . . . 74.409999999999997 110.34 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -119.74 42.47 1.75 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.444 -0.884 . . . . 60.530000000000001 112.107 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.0 m -140.19 91.17 2.43 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.068 0.461 . . . . 73.530000000000001 109.81 178.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 m -129.04 93.63 3.64 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.825 -0.625 . . . . 73.310000000000002 110.607 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -133.56 88.36 2.47 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.128 -0.487 . . . . 71.129999999999995 111.09 176.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -113.59 118.47 34.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.759 -0.655 . . . . 71.439999999999998 109.477 173.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -158.77 113.16 2.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.258 -0.428 . . . . 75.319999999999993 110.201 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -141.52 127.05 18.9 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.778 -0.647 . . . . 71.150000000000006 109.847 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -170.74 82.79 0.09 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.208 -0.451 . . . . 62.219999999999999 110.036 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -150.87 93.2 1.91 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.394 -0.366 . . . . 60.229999999999997 111.029 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.2 m -156.59 94.65 1.49 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.974 -0.557 . . . . 74.549999999999997 109.593 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.0 m -148.0 126.8 12.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.809 0.299 . . . . 70.230000000000004 111.809 -177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 92.69 130.4 5.31 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.119 -0.562 . . . . 62.009999999999998 114.189 170.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.72 157.27 37.8 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.231 -0.655 . . . . 74.150000000000006 109.231 170.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -129.41 119.53 23.97 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.072 0.463 . . . . 70.340000000000003 111.386 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -161.26 109.5 1.53 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.635 -0.712 . . . . 72.510000000000005 110.463 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.1 mt -85.41 105.67 16.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.992 0.425 . . . . 61.140000000000001 110.279 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -82.53 152.33 26.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.854 -0.612 . . . . 73.409999999999997 110.638 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -160.83 127.21 4.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.382 -0.372 . . . . 73.329999999999998 110.834 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.434 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 6.1 mm-40 -150.97 146.95 26.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.097 -0.501 . . . . 73.030000000000001 110.138 175.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 174.16 80.16 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.762 -0.733 . . . . 72.430000000000007 112.284 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.458 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 55.9 t-80 -164.28 149.1 10.01 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.85 -0.426 . . . . 74.530000000000001 109.85 -178.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.4 ' HG ' ' HA ' ' A' ' 73' ' ' HIS . 6.5 mp -124.96 144.26 50.46 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.83 -0.433 . . . . 72.340000000000003 109.83 175.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -115.71 148.74 39.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.622 0.249 . . . . 73.5 111.263 -176.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.932 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.8 tt0 -84.13 121.4 27.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.957 -0.565 . . . . 62.420000000000002 110.51 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.429 ' CD1' HG23 ' A' ' 72' ' ' VAL . 9.8 mp -100.6 -66.21 0.92 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.803 0.668 . . . . 75.420000000000002 112.803 -173.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.604 ' CB ' ' HA ' ' A' ' 93' ' ' LEU . 2.4 pt? -142.25 169.22 18.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.18 0.514 . . . . 73.019999999999996 111.934 -171.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -100.87 136.19 41.11 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.089 -0.96 . . . . 73.010000000000005 109.443 176.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.8 p -117.74 92.32 3.81 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.539 0.685 . . . . 70.430000000000007 111.172 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.418 ' H ' HD21 ' A' ' 30' ' ' ASN . 0.1 OUTLIER -111.54 9.53 21.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.817 0.818 . . . . 74.0 109.352 175.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.464 ' HB3' ' HB3' ' A' ' 34' ' ' LEU . 18.1 t70 -114.03 125.53 54.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.83 -1.077 . . . . 64.310000000000002 109.799 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.24 -44.02 97.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.19 -0.459 . . . . 73.439999999999998 111.602 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 46.9 t -70.76 -44.58 76.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.309 -0.405 . . . . 62.32 110.668 -176.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' A' ' 92' ' ' GLU . 29.2 tp -58.65 -42.74 89.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.969 -0.56 . . . . 71.209999999999994 111.204 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 64.8 tp -62.49 -35.79 80.48 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.176 -0.465 . . . . 62.439999999999998 110.875 -177.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.2 m -70.55 -42.38 71.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 54.240000000000002 110.648 176.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.425 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.72 -54.1 31.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 63.229999999999997 111.537 -177.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.483 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 87.1 t -62.7 -41.07 90.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.997 0.427 . . . . 64.340000000000003 110.662 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.36 -34.33 89.62 Favored Glycine 0 N--CA 1.453 -0.196 0 CA-C-N 115.784 -0.644 . . . . 64.420000000000002 112.489 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.57 -36.28 68.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 55.520000000000003 110.779 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 87.2 mt -65.74 -46.3 79.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.996 -0.547 . . . . 73.409999999999997 110.501 178.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 38' ' ' VAL . 85.7 mt -59.02 -47.77 84.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.577 -0.738 . . . . 64.349999999999994 110.559 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -68.56 -37.51 79.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.131 -0.486 . . . . 75.019999999999996 110.856 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.1 -20.76 67.36 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 115.788 -0.642 . . . . 55.420000000000002 113.182 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.405 ' HB3' HG13 ' A' ' 47' ' ' ILE . . . -109.68 7.97 24.6 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.802 -0.234 . . . . 75.430000000000007 111.218 179.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.7 t70 61.07 33.99 19.33 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.748 0.785 . . . . 72.239999999999995 110.665 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.913 HG21 ' HB3' ' A' ' 76' ' ' ASP . 84.8 mt -82.41 120.25 33.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.521 -0.763 . . . . 63.310000000000002 110.321 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.68 109.45 2.91 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.927 -0.654 . . . . 71.420000000000002 111.747 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -126.39 148.14 49.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.976 0.417 . . . . 72.310000000000002 111.065 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 65.5 tp -127.99 127.98 44.2 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.774 -0.648 . . . . 73.129999999999995 109.579 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.3 m -102.77 126.32 57.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.989 0.423 . . . . 74.219999999999999 110.948 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.818 HD23 HD12 ' A' ' 71' ' ' LEU . 4.0 mm? -102.82 114.46 28.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.915 -0.584 . . . . 70.409999999999997 109.61 176.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -86.62 -64.31 1.17 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.418 -0.355 . . . . 54.25 110.764 -176.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 68.07 120.86 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 O-C-N 124.125 0.89 . . . . 61.350000000000001 112.384 178.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -114.55 167.03 11.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.761 -0.654 . . . . 61.240000000000002 109.838 173.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.22 153.96 42.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.8 0.333 . . . . 73.310000000000002 111.486 -175.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.0 m -59.98 157.21 13.12 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.879 -0.6 . . . . 72.030000000000001 111.034 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.57 ' O ' ' HB2' ' A' ' 59' ' ' LEU . 5.4 tp -72.58 96.23 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-O 121.272 0.558 . . . . 65.129999999999995 111.535 -177.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.57 ' HB2' ' O ' ' A' ' 58' ' ' ILE . 0.5 OUTLIER 167.31 97.73 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.128 -1.064 . . . . 62.020000000000003 108.128 177.068 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 64.88 92.33 0.07 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.552 0.691 . . . . 74.530000000000001 110.533 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -114.1 46.48 1.16 Allowed Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.743 -0.741 . . . . 43.520000000000003 113.196 -176.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.8 p -83.47 -54.75 4.74 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.011 0.434 . . . . 42.039999999999999 110.33 174.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.2 mp -110.77 134.53 52.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.179 -0.464 . . . . 75.349999999999994 110.503 178.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -134.62 -67.05 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.436 -0.666 . . . . 74.310000000000002 111.436 176.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.5 t 59.95 64.66 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-O 121.64 0.733 . . . . 73.019999999999996 110.363 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.8 mp -103.86 111.17 65.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.516 -0.765 . . . . 54.119999999999997 109.282 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.89 114.82 3.3 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.498 2.132 . . . . 44.020000000000003 111.813 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 -58.96 136.89 58.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.505 -0.554 . . . . 72.219999999999999 109.505 175.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -113.35 139.45 48.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.853 0.358 . . . . 74.420000000000002 110.905 -175.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.4 t -105.38 118.49 52.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.02 -0.536 . . . . 62.119999999999997 110.68 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.932 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.9 mp -114.96 150.23 36.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.843 -0.617 . . . . 71.439999999999998 109.771 177.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.802 HG22 HD21 ' A' ' 77' ' ' LEU . 34.4 m -130.56 163.3 36.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.295 0.569 . . . . 72.019999999999996 111.233 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.44 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 41.2 t-80 -75.87 150.89 37.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.274 -0.875 . . . . 73.319999999999993 110.841 -176.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 24.4 mm-40 -38.74 -64.72 0.42 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.148 1.166 . . . . 73.030000000000001 114.148 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -67.38 -19.09 65.36 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.442 0.639 . . . . 72.430000000000007 110.963 -174.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.913 ' HB3' HG21 ' A' ' 47' ' ' ILE . 2.4 m-20 -85.73 -14.06 46.47 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.343 -0.844 . . . . 71.420000000000002 110.613 -176.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.802 HD21 HG22 ' A' ' 72' ' ' VAL . 1.6 mm? -52.72 -57.94 8.47 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.095 -0.502 . . . . 74.099999999999994 111.409 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.56 -42.88 83.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.996 -0.547 . . . . 55.140000000000001 111.056 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.42 -48.11 77.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.813 -0.708 . . . . 54.030000000000001 112.555 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.469 ' HB3' HG23 ' A' ' 47' ' ' ILE . . . -65.47 -47.31 76.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.648 0.261 . . . . 75.230000000000004 111.417 -178.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.515 ' HD2' HD12 ' A' ' 77' ' ' LEU . 39.3 mtp180 -64.44 -38.83 92.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.402 -0.363 . . . . 72.310000000000002 110.582 -177.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 82' ' ' ARG . 40.9 ttt-85 -66.42 -44.33 83.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.116 0.484 . . . . 71.420000000000002 110.389 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.4 tp -62.31 -47.52 83.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.586 -0.733 . . . . 74.409999999999997 111.283 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.87 -28.72 70.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 63.299999999999997 110.962 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.9 m -74.46 -39.15 62.7 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.827 0.346 . . . . 75.200000000000003 110.505 177.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -66.49 -37.02 84.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.024 0.44 . . . . 73.340000000000003 110.688 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.26 -17.27 52.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.971 -0.559 . . . . 74.310000000000002 111.172 178.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 78.16 28.54 55.92 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.863 -0.608 . . . . 73.200000000000003 112.796 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.8 mt -103.56 5.09 36.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.977 0.418 . . . . 74.019999999999996 110.639 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.795 ' HA ' HD12 ' A' ' 93' ' ' LEU . . . -76.22 73.03 3.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.297 0.57 . . . . 64.310000000000002 110.681 178.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -129.31 -34.24 1.86 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.759 -0.655 . . . . 63.140000000000001 110.407 179.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.57 ' HG3' HD22 ' A' ' 34' ' ' LEU . 51.7 mm-40 -98.18 8.7 44.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.582 -0.735 . . . . 75.019999999999996 111.011 -175.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.795 HD12 ' HA ' ' A' ' 90' ' ' ALA . 7.8 mp -80.99 121.34 25.92 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.822 -0.436 . . . . 65.400000000000006 109.822 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -79.43 80.19 5.82 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.51 0.671 . . . . 65.019999999999996 110.327 -177.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 39.6 t -111.98 83.66 1.83 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.263 -0.88 . . . . 71.349999999999994 108.994 175.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -64.89 -34.73 79.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.581 0.705 . . . . 75.329999999999998 109.116 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 p30 . . . . . 0 C--O 1.254 1.293 0 CA-C-N 114.858 -1.065 . . . . 71.409999999999997 109.254 176.378 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.4 ttp . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.802 0.335 . . . . 74.140000000000001 110.247 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.12 60.14 0.92 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.518 -0.849 . . . . 72.099999999999994 112.505 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 10.7 m -77.78 99.77 6.02 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.465 -0.568 . . . . 73.319999999999993 109.465 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.9 t -129.9 101.34 5.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.459 -0.337 . . . . 63.229999999999997 110.942 -174.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -82.76 132.3 35.18 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.624 -0.51 . . . . 64.430000000000007 109.624 176.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -98.9 122.82 42.65 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.253 0.549 . . . . 72.420000000000002 111.565 -173.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.0 p-80 -133.23 115.44 14.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.374 -0.83 . . . . 75.510000000000005 109.171 175.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 18.8 t-80 -138.28 -15.9 1.25 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.284 -0.416 . . . . 72.430000000000007 110.737 -176.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -76.61 77.07 3.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.184 0.516 . . . . 72.239999999999995 110.314 177.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -93.5 -33.6 13.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.62 -0.718 . . . . 75.140000000000001 109.646 178.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -82.65 114.1 20.79 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.516 -0.766 . . . . 71.510000000000005 110.066 177.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.0 t -140.22 107.65 5.56 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.991 -0.549 . . . . 70.099999999999994 110.482 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 107.2 146.99 13.41 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 111.325 -0.71 . . . . 53.140000000000001 111.325 -176.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.5 ptp85 -143.18 -14.65 0.69 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.141 0.47 . . . . 71.230000000000004 111.931 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -78.56 81.35 4.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.801 0.81 . . . . 75.400000000000006 110.803 -177.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -126.81 37.88 4.21 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.573 -1.269 . . . . 74.400000000000006 107.573 175.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.99 98.41 5.69 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.582 -1.19 . . . . 74.209999999999994 110.725 -174.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -123.88 -74.28 0.62 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.536 -0.913 . . . . 74.450000000000003 108.536 171.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.0 t80 70.26 -8.64 0.84 Allowed 'General case' 0 N--CA 1.471 0.586 0 O-C-N 123.96 0.787 . . . . 74.5 112.361 170.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -58.08 124.12 18.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.207 -0.451 . . . . 73.409999999999997 110.989 -177.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.589 ' HA3' ' HB2' ' A' ' 74' ' ' GLU . . . 146.8 111.71 0.69 Allowed Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 119.719 -1.229 . . . . 62.439999999999998 113.528 176.138 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -85.52 6.63 26.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.819 0.343 . . . . 70.310000000000002 110.434 172.407 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 22' ' ' HIS . 11.0 mp 84.31 139.17 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.22 1.008 . . . . 64.200000000000003 112.479 173.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -117.17 155.24 29.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.018 -0.992 . . . . 71.150000000000006 109.442 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.843 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 37.5 tt0 -85.09 121.87 28.49 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.844 -0.799 . . . . 75.219999999999999 108.844 171.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.415 ' O ' ' HA ' ' A' ' 93' ' ' LEU . 10.9 mp -87.42 -66.53 0.9 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.359 -0.382 . . . . 74.329999999999998 111.433 -176.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.513 HD21 HG12 ' A' ' 38' ' ' VAL . 4.0 pp -143.02 160.83 39.63 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.718 -0.393 . . . . 75.420000000000002 111.041 -175.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -144.07 129.18 18.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.513 -0.767 . . . . 74.299999999999997 109.385 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.2 t -151.49 163.46 38.96 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.964 0.411 . . . . 73.129999999999995 110.814 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -110.69 0.59 17.51 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.803 -0.635 . . . . 64.040000000000006 110.758 -177.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -94.43 123.55 37.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.892 0.377 . . . . 75.109999999999999 110.768 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.26 -27.77 63.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 61.200000000000003 111.75 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.28 -50.53 72.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.954 0.407 . . . . 71.319999999999993 110.284 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.7 tp -62.4 -40.19 95.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.067 -0.515 . . . . 74.420000000000002 110.47 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.504 HD23 ' HD2' ' A' ' 68' ' ' ARG . 76.7 mt -62.15 -31.28 71.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.859 -0.61 . . . . 73.409999999999997 111.351 177.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.0 m -75.6 -44.84 40.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.792 0.33 . . . . 75.219999999999999 110.501 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.475 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -59.94 -50.5 73.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 64.340000000000003 111.055 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.513 HG12 HD21 ' A' ' 27' ' ' LEU . 95.8 t -69.84 -41.93 79.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-O 121.104 0.478 . . . . 72.420000000000002 110.448 178.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.62 -49.13 81.83 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.742 -0.663 . . . . 53.340000000000003 112.793 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.43 -26.41 67.85 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.704 0.261 . . . . 65.549999999999997 111.704 -177.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.56 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.6 mt -69.9 -52.25 26.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.018 0.437 . . . . 73.219999999999999 110.616 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.3 mt -74.5 -39.58 62.35 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.015 -0.538 . . . . 74.540000000000006 111.067 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -68.61 -42.4 78.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.998 -0.546 . . . . 74.129999999999995 110.794 -177.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.96 -29.31 67.18 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 121.12 -0.562 . . . . 51.530000000000001 112.737 -177.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -85.74 -0.75 56.08 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.68 -0.306 . . . . 74.510000000000005 111.184 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.7 t70 66.82 21.23 10.51 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.611 0.72 . . . . 74.349999999999994 110.941 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 63.6 mt -75.84 142.83 13.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.699 -0.682 . . . . 73.5 109.528 177.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.52 113.44 4.91 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.963 -0.637 . . . . 61.329999999999998 111.832 177.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 33.6 p-80 -128.3 99.3 5.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.328 0.585 . . . . 60.409999999999997 111.532 -173.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.6 tp -83.21 89.0 6.91 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.839 -0.619 . . . . 70.540000000000006 109.373 176.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.655 HG12 HG22 ' A' ' 70' ' ' VAL . 14.9 m -107.29 114.18 45.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.592 -0.731 . . . . 72.439999999999998 110.502 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 pp -130.82 135.25 47.56 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.054 -0.521 . . . . 73.230000000000004 110.79 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.479 ' HA ' ' HA ' ' A' ' 68' ' ' ARG . 2.5 p30 -107.59 175.43 5.49 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.539 -0.541 . . . . 71.319999999999993 109.539 175.36 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -113.39 86.35 2.37 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.16 0.505 . . . . 73.230000000000004 112.005 -172.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -110.44 96.51 6.24 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.488 -0.93 . . . . 54.25 108.488 169.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 27.9 ttt -122.62 77.23 1.41 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.88 -0.328 . . . . 73.010000000000005 111.304 -172.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.3 t 62.48 103.99 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.898 0.749 . . . . 73.340000000000003 112.035 174.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.3 tt -69.04 128.41 32.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.178 0.513 . . . . 63.549999999999997 110.36 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.608 HD23 ' HG2' ' A' ' 60' ' ' GLU . 5.8 tt -121.79 107.37 12.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.939 -0.763 . . . . 75.400000000000006 108.939 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.608 ' HG2' HD23 ' A' ' 59' ' ' LEU . 12.7 pt-20 43.73 -156.24 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 O-C-N 124.308 1.005 . . . . 64.0 112.262 -175.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -72.12 71.91 0.95 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.121 -0.561 . . . . 41.530000000000001 112.367 178.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.6 t -143.35 125.44 15.38 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.51 -0.552 . . . . 70.120000000000005 109.51 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -100.28 -34.57 9.94 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.285 0.564 . . . . 72.349999999999994 110.068 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.64 -135.67 27.05 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 115.518 -0.765 . . . . 63.030000000000001 111.398 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.567 ' O ' ' HD3' ' A' ' 67' ' ' PRO . 58.7 t -134.47 126.36 48.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.103 -0.703 . . . . 71.209999999999994 109.103 176.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.4 mp -110.68 85.69 5.06 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 110.019 -0.363 . . . . 73.140000000000001 110.019 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.567 ' HD3' ' O ' ' A' ' 65' ' ' VAL . 49.0 Cg_endo -97.57 105.99 0.08 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 123.256 2.637 . . . . 60.340000000000003 112.143 177.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.504 ' HD2' HD23 ' A' ' 35' ' ' LEU . 42.2 ttm180 -74.01 132.66 42.6 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.391 -0.596 . . . . 74.140000000000001 109.391 177.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -113.02 134.49 54.49 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.883 -0.599 . . . . 75.019999999999996 109.514 -174.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.655 HG22 HG12 ' A' ' 51' ' ' VAL . 42.5 t -112.85 118.63 58.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.097 -0.501 . . . . 73.219999999999999 110.8 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.843 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.1 mp -122.71 143.03 50.07 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.136 -0.484 . . . . 74.25 110.058 177.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.5 HG22 HD22 ' A' ' 77' ' ' LEU . 33.0 m -133.56 169.91 20.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.728 -0.215 . . . . 71.010000000000005 110.59 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -74.01 142.19 45.78 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.184 -0.673 . . . . 74.200000000000003 109.184 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.742 ' HA ' HD21 ' A' ' 77' ' ' LEU . 40.3 mt-10 -73.57 -8.46 56.06 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.198 0.814 . . . . 71.349999999999994 113.198 -171.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -86.31 -23.69 26.17 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.204 0.526 . . . . 73.420000000000002 109.77 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -101.18 8.65 42.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.745 -0.661 . . . . 73.549999999999997 110.132 172.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.742 HD21 ' HA ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -59.05 -55.39 35.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.823 -0.626 . . . . 72.439999999999998 110.115 -178.291 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.38 -36.32 71.11 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.129 -0.487 . . . . 64.409999999999997 111.12 177.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.37 -49.14 72.67 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.982 -0.628 . . . . 74.530000000000001 112.007 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.05 -42.94 93.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.502 0.192 . . . . 75.040000000000006 111.108 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.639 ' HD2' HD12 ' A' ' 77' ' ' LEU . 74.8 mtp180 -58.64 -47.25 85.05 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.507 -0.315 . . . . 74.140000000000001 110.412 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -58.72 -47.26 85.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 75.340000000000003 110.304 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.56 HD21 ' HB3' ' A' ' 41' ' ' LEU . 46.8 tp -60.94 -49.61 76.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.729 -0.669 . . . . 75.209999999999994 111.101 -178.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.485 HD22 HG13 ' A' ' 38' ' ' VAL . 84.5 mt -64.93 -36.77 85.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.471 -0.331 . . . . 75.109999999999999 111.351 -178.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 33.2 m -70.99 -41.76 70.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.899 0.38 . . . . 72.310000000000002 110.404 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -65.98 -34.51 78.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.939 -0.573 . . . . 64.540000000000006 110.694 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.54 -34.29 60.73 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.932 -0.576 . . . . 70.319999999999993 111.195 177.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 98.96 28.64 7.66 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.807 -0.711 . . . . 75.049999999999997 111.916 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 97.4 mt -113.79 -1.9 13.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.154 0.502 . . . . 74.040000000000006 110.897 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.571 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -75.0 93.61 2.74 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.547 . . . . 54.340000000000003 110.024 177.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -155.13 -44.71 0.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.96 -0.564 . . . . 75.120000000000005 110.346 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -84.27 10.6 10.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.097 -0.501 . . . . 65.5 111.209 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.571 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.3 mp -77.79 101.08 6.55 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.191 -0.459 . . . . 64.200000000000003 109.764 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.434 ' HD2' ' HA ' ' A' ' 94' ' ' ARG . 15.2 tpt180 -98.61 107.23 19.63 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.245 -0.434 . . . . 74.209999999999994 110.494 -175.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.7 p -121.37 170.2 9.86 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.869 -0.605 . . . . 75.349999999999994 110.615 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -89.74 103.05 15.73 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.292 -0.413 . . . . 73.140000000000001 110.112 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.33 -0.843 . . . . 73.400000000000006 109.692 177.377 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.9 tpt . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.637 0.256 . . . . 74.239999999999995 110.711 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.2 -6.56 0.15 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.018 -1.087 . . . . 74.450000000000003 113.177 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.1 p -76.39 100.42 5.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.194 0.521 . . . . 63.219999999999999 110.867 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.6 m -152.01 -171.17 3.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.921 -0.581 . . . . 74.540000000000006 109.682 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.6 t60 75.06 -36.0 0.3 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.077 0.551 . . . . 72.340000000000003 111.756 177.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -77.12 86.62 3.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.447 0.641 . . . . 75.540000000000006 109.887 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -135.96 121.95 20.07 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.495 -0.775 . . . . 73.230000000000004 109.202 -177.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -152.29 155.09 37.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.752 -0.203 . . . . 73.129999999999995 110.869 -177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -159.92 106.5 1.62 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.966 0.413 . . . . 73.409999999999997 110.292 176.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.7 t-80 -139.34 80.85 1.8 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.884 -0.598 . . . . 73.319999999999993 109.988 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.7 p -98.68 91.36 5.08 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.006 -0.543 . . . . 63.140000000000001 110.687 -178.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.1 p -132.58 110.89 10.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.046 -0.525 . . . . 63.240000000000002 111.095 -177.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 135.15 131.65 3.08 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.476 -0.869 . . . . 61.009999999999998 112.354 178.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -118.49 -37.38 3.32 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.8 0.333 . . . . 74.129999999999995 110.525 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -99.4 109.71 22.27 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.4 0.619 . . . . 64.230000000000004 110.682 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -160.46 31.6 0.16 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.902 -1.147 . . . . 72.140000000000001 107.902 175.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 76.9 mt -78.73 102.23 7.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.473 -1.239 . . . . 63.039999999999999 111.779 -171.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -122.05 139.36 53.8 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.659 -0.867 . . . . 73.129999999999995 108.659 172.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -67.76 -46.31 72.44 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 123.411 0.444 . . . . 72.109999999999999 111.64 -168.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.19 100.61 10.14 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.662 -0.496 . . . . 73.409999999999997 109.662 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -97.09 1.77 61.09 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.471 -0.871 . . . . 62.100000000000001 113.535 -173.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.429 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 53.5 t60 -97.62 10.62 39.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 117.088 0.444 . . . . 73.430000000000007 110.57 -177.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.596 HD21 ' HB2' ' A' ' 50' ' ' LEU . 8.6 mp 71.23 148.69 0.08 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.99 -0.55 . . . . 72.109999999999999 111.515 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 50.7 mtm180 -110.35 145.39 37.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.288 -0.415 . . . . 70.420000000000002 111.348 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.534 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 32.1 tt0 -70.88 110.96 5.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.651 -0.704 . . . . 70.040000000000006 109.877 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.482 HD22 HG21 ' A' ' 72' ' ' VAL . 57.0 tp -98.85 -38.23 9.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.211 -0.45 . . . . 54.240000000000002 111.348 -174.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.592 ' HG ' ' HB ' ' A' ' 70' ' ' VAL . 1.0 OUTLIER -142.55 148.8 38.16 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.259 0.552 . . . . 74.400000000000006 110.805 179.362 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 28' ' ' ARG . 22.5 ttt180 -138.63 104.61 5.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.334 -0.848 . . . . 71.319999999999993 109.113 -174.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.7 t -121.14 175.84 5.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.43 0.633 . . . . 63.32 112.052 -170.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -130.34 17.54 5.43 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.019 -0.991 . . . . 72.230000000000004 110.58 -175.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -128.34 126.58 41.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 72.310000000000002 111.25 -177.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.663 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -76.95 -26.39 53.95 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.067 -0.515 . . . . 72.120000000000005 111.678 -177.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.9 t -68.71 -45.9 80.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.077 0.465 . . . . 74.329999999999998 109.842 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.15 -38.86 90.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.857 -0.611 . . . . 73.219999999999999 110.303 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.663 HD12 ' HA ' ' A' ' 32' ' ' ALA . 69.1 mt -58.37 -37.7 75.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 74.209999999999994 111.281 176.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.3 m -64.99 -37.05 86.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 51.530000000000001 110.276 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.423 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.74 -54.15 8.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.999 -0.546 . . . . 65.409999999999997 111.08 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.544 HG11 HD13 ' A' ' 27' ' ' LEU . 99.5 t -60.58 -38.78 79.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.247 -0.433 . . . . 73.5 111.075 -178.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.66 -51.48 58.44 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.864 -0.607 . . . . 74.340000000000003 112.196 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.23 72.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.644 0.259 . . . . 53.229999999999997 111.355 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 84.1 mt -65.69 -52.14 53.83 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.937 0.399 . . . . 62.020000000000003 110.725 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.4 mt -70.53 -39.1 74.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.919 -0.582 . . . . 74.299999999999997 110.563 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.73 -36.74 81.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 71.010000000000005 110.403 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.85 -24.25 62.51 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 121.047 -0.596 . . . . 64.109999999999999 113.067 -179.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.61 6.82 42.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.927 0.364 . . . . 74.120000000000005 111.464 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.1 t70 67.42 21.2 9.75 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.479 0.657 . . . . 64.420000000000002 110.372 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.804 HG22 ' HB3' ' A' ' 76' ' ' ASP . 78.5 mt -83.14 128.48 38.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.053 -0.521 . . . . 75.129999999999995 110.268 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.32 113.48 5.87 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.104 -0.57 . . . . 71.400000000000006 112.056 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.56 137.54 52.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.117 0.484 . . . . 74.430000000000007 111.431 -177.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.828 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 5.9 tt -107.79 95.17 5.5 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.901 -0.778 . . . . 75.239999999999995 108.901 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.447 HG11 HG21 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -142.98 110.9 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.582 -0.736 . . . . 64.25 110.176 178.144 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -113.67 135.51 53.85 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.108 -0.496 . . . . 74.329999999999998 110.886 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -81.23 68.62 7.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.751 0.786 . . . . 63.229999999999997 109.791 175.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -136.7 117.14 13.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.96 -1.018 . . . . 72.129999999999995 109.433 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -152.96 -50.83 0.1 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.903 -0.59 . . . . 72.400000000000006 110.091 -177.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -151.78 171.54 17.54 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.1 -0.704 . . . . 44.100000000000001 109.1 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.6 m -70.53 146.8 49.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 110.174 -0.306 . . . . 71.420000000000002 110.174 177.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 8.1 tt -73.35 116.36 15.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.393 0.615 . . . . 75.25 111.135 -178.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.0 tp -158.34 111.17 2.35 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.44 -0.8 . . . . 70.25 109.901 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 67.89 170.46 0.27 Allowed 'General case' 0 C--O 1.234 0.24 0 O-C-N 123.815 0.697 . . . . 72.319999999999993 111.111 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -80.05 91.22 1.31 Allowed Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 110.901 -0.879 . . . . 64.420000000000002 110.901 172.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.651 ' HB3' HG13 ' A' ' 65' ' ' VAL . 15.6 m -54.73 127.72 29.54 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 122.715 0.406 . . . . 63.219999999999999 111.281 -175.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.436 HD13 ' N ' ' A' ' 63' ' ' LEU . 6.3 mp -80.15 80.63 6.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.904 -0.589 . . . . 71.400000000000006 111.496 -174.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 53.58 41.25 64.33 Favored Glycine 0 C--N 1.332 0.313 0 CA-C-N 115.861 -0.609 . . . . 73.209999999999994 113.717 175.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.651 HG13 ' HB3' ' A' ' 62' ' ' SER . 9.7 p -105.96 15.24 7.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.467 0.651 . . . . 72.219999999999999 110.615 -177.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.3 mp -120.22 88.07 40.95 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.279 -0.419 . . . . 74.140000000000001 110.634 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -81.65 141.41 12.29 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.357 2.038 . . . . 65.400000000000006 110.251 171.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.464 ' HA ' ' NE ' ' A' ' 68' ' ' ARG . 5.3 mmp_? -127.57 150.83 49.54 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.46 0.648 . . . . 75.530000000000001 111.417 -175.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.488 ' HD3' ' OE1' ' A' ' 25' ' ' GLU . 18.9 ptp180 -114.72 136.85 52.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.832 -1.076 . . . . 74.329999999999998 108.948 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.592 ' HB ' ' HG ' ' A' ' 27' ' ' LEU . 97.8 t -108.52 114.4 46.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 120.953 0.406 . . . . 72.25 110.272 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.828 ' HB2' ' HB3' ' A' ' 50' ' ' LEU . 8.5 mp -101.53 140.12 36.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.573 -0.74 . . . . 71.430000000000007 109.4 176.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.864 HG22 HD22 ' A' ' 77' ' ' LEU . 23.9 m -126.16 162.94 28.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.325 0.583 . . . . 71.319999999999993 111.13 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.456 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 2.5 t-160 -74.22 162.19 29.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.079 -0.964 . . . . 70.340000000000003 110.257 -175.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.576 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 26.0 mm-40 -58.09 -58.88 6.49 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.85 0.685 . . . . 72.25 112.85 -174.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -73.33 -25.31 60.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.557 0.694 . . . . 72.239999999999995 110.041 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.804 ' HB3' HG22 ' A' ' 47' ' ' ILE . 1.5 m-20 -74.24 -14.65 60.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.168 -0.923 . . . . 63.539999999999999 110.63 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.864 HD22 HG22 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -53.49 -57.79 9.44 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.01 0.524 . . . . 71.040000000000006 111.249 -177.338 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.8 -38.34 90.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.691 -0.686 . . . . 70.129999999999995 111.04 -178.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.52 -44.99 94.37 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.902 -0.666 . . . . 74.420000000000002 112.124 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.58 97.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.728 0.299 . . . . 74.319999999999993 110.714 179.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -60.88 -50.94 71.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.43 . . . . 63.32 110.59 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -57.67 -43.95 85.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 64.510000000000005 110.819 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.6 tp -59.84 -54.74 42.67 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.028 -0.533 . . . . 72.030000000000001 111.054 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.483 HD23 HG12 ' A' ' 38' ' ' VAL . 90.4 mt -63.18 -30.78 71.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.996 -0.547 . . . . 75.310000000000002 111.385 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 88.4 m -66.79 -43.0 85.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.573 0.225 . . . . 72.349999999999994 110.812 178.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -69.09 -34.11 74.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.978 0.418 . . . . 60.509999999999998 110.582 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.95 -4.26 54.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.904 -0.589 . . . . 73.109999999999999 111.673 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 72.32 21.67 79.24 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.99 -0.624 . . . . 72.030000000000001 112.785 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.0 mt -105.47 10.26 33.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.08 0.467 . . . . 73.209999999999994 110.829 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.709 ' HA ' HD11 ' A' ' 93' ' ' LEU . . . -73.78 77.09 1.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.45 -0.574 . . . . 61.530000000000001 109.45 174.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -131.56 -51.22 0.99 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.332 -0.849 . . . . 71.439999999999998 110.421 -172.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -91.74 8.83 35.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.598 -0.728 . . . . 75.420000000000002 110.974 -176.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.709 HD11 ' HA ' ' A' ' 90' ' ' ALA . 9.3 mp -73.47 134.37 43.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.168 -0.469 . . . . 73.5 110.319 -178.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 53.3 mtt180 -149.8 165.35 32.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.064 -0.516 . . . . 72.109999999999999 110.8 -177.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 68.9 m -152.96 139.7 18.93 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.609 -0.723 . . . . 71.420000000000002 109.123 173.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -80.66 83.33 6.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.522 -0.547 . . . . 74.129999999999995 109.522 178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 27.2 t70 . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.466 -0.778 . . . . 73.319999999999993 110.507 -174.838 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 110.045 -0.354 . . . . 62.020000000000003 110.045 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 102.24 126.66 5.9 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.599 -0.81 . . . . 61.43 112.951 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.4 t -130.94 125.47 33.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.648 -0.871 . . . . 70.219999999999999 108.648 173.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.3 m -139.78 117.96 11.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.112 0.482 . . . . 60.119999999999997 111.658 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -162.7 96.01 0.92 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.614 -0.721 . . . . 75.430000000000007 109.748 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -140.3 92.16 2.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.831 0.824 . . . . 72.409999999999997 111.194 178.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -131.68 85.75 2.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.743 -0.662 . . . . 74.430000000000007 109.825 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.3 t-80 -160.2 84.04 0.72 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.787 -0.642 . . . . 71.540000000000006 110.457 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -157.46 42.65 0.32 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.45 -0.574 . . . . 74.010000000000005 109.45 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 35.9 t-80 -83.98 86.92 7.12 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.975 -0.75 . . . . 74.010000000000005 108.975 176.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.6 m -155.07 102.66 2.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.695 -0.684 . . . . 63.109999999999999 109.92 -175.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -149.65 114.42 5.33 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.374 -0.376 . . . . 73.25 110.399 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -107.86 169.66 14.69 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.733 -0.746 . . . . 62.219999999999999 111.795 178.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -115.71 102.78 10.05 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.063 0.459 . . . . 73.519999999999996 110.792 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -82.97 132.66 35.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.035 0.445 . . . . 73.019999999999996 110.071 177.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -93.91 123.36 37.22 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.938 -0.574 . . . . 61.409999999999997 110.914 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.8 mt -135.11 106.26 6.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.166 -0.47 . . . . 73.439999999999998 110.777 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -92.98 -66.42 0.93 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.027 0.441 . . . . 74.439999999999998 109.973 174.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.0 t80 62.56 -170.53 0.17 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.062 -0.972 . . . . 74.230000000000004 109.836 -176.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -142.52 136.37 29.27 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.172 -0.677 . . . . 74.230000000000004 109.172 178.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -135.11 -68.24 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 119.702 -1.237 . . . . 70.439999999999998 113.28 -176.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 32.9 m80 57.27 83.45 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.35 -0.611 . . . . 74.519999999999996 109.35 -169.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.3 mt 66.55 101.17 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.343 -0.844 . . . . 74.049999999999997 110.027 -168.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.48 ' HB2' HD23 ' A' ' 77' ' ' LEU . 87.7 mtt180 -107.11 147.78 29.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.082 -0.508 . . . . 73.409999999999997 110.189 -174.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.602 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 35.7 tt0 -72.83 136.67 45.41 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.529 -0.545 . . . . 73.010000000000005 109.529 177.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.587 HD11 HD23 ' A' ' 27' ' ' LEU . 1.4 tm? -97.75 -50.45 4.45 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.716 -0.476 . . . . 62.130000000000003 109.716 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.587 HD23 HD11 ' A' ' 26' ' ' LEU . 2.6 pt? -158.39 157.98 33.35 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.472 -0.331 . . . . 75.099999999999994 110.805 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.19 132.03 42.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.834 -0.621 . . . . 63.539999999999999 110.16 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.4 t -142.99 170.96 14.72 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.917 -0.401 . . . . 74.299999999999997 109.917 176.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.637 ' HA ' ' HA ' ' A' ' 67' ' ' PRO . 4.2 p-10 -116.67 9.63 14.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.347 0.594 . . . . 71.540000000000006 110.008 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -117.09 128.37 55.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.539 -0.755 . . . . 71.349999999999994 111.266 -175.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.696 ' HA ' HD13 ' A' ' 35' ' ' LEU . . . -77.54 -21.07 53.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.819 -0.628 . . . . 61.310000000000002 111.705 -176.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.7 t -69.18 -49.39 62.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.156 0.503 . . . . 75.329999999999998 109.849 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.5 tp -60.91 -37.51 82.52 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.641 -0.709 . . . . 63.340000000000003 110.231 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.696 HD13 ' HA ' ' A' ' 32' ' ' ALA . 78.5 mt -59.34 -35.15 73.32 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.98 -0.555 . . . . 61.299999999999997 111.072 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -69.74 -42.54 73.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.4 -0.364 . . . . 72.340000000000003 110.445 179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.77 -53.17 44.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 63.439999999999998 111.04 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.52 HG11 HD21 ' A' ' 84' ' ' LEU . 99.1 t -61.43 -40.57 86.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 121.127 0.489 . . . . 74.230000000000004 110.591 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.4 -48.48 85.97 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.685 -0.689 . . . . 73.209999999999994 111.979 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.63 -28.48 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 62.439999999999998 111.443 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 88.3 mt -67.13 -51.64 51.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.863 0.364 . . . . 72.049999999999997 110.559 177.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 82.5 mt -72.43 -39.11 68.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.98 -0.555 . . . . 75.120000000000005 110.665 -177.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -66.92 -41.2 87.45 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.463 -0.79 . . . . 73.230000000000004 110.666 -178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -80.08 -11.79 84.03 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.622 -0.799 . . . . 62.549999999999997 112.83 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -102.85 4.22 37.5 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.711 -0.288 . . . . 70.019999999999996 111.225 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.4 t70 63.15 32.48 15.11 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.682 0.753 . . . . 73.150000000000006 110.575 178.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 68.6 mt -93.58 130.09 43.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.884 -0.598 . . . . 63.119999999999997 110.308 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.18 117.96 6.59 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.929 -0.578 . . . . 62.32 112.165 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 54.0 p-80 -139.53 142.53 37.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.078 0.466 . . . . 74.329999999999998 110.935 -175.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 tp -113.31 115.82 28.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.971 -0.558 . . . . 73.230000000000004 110.824 -176.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.7 m -132.25 136.31 56.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.582 -0.736 . . . . 73.420000000000002 109.753 173.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 mp -104.82 -86.67 0.46 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.288 -0.264 . . . . 74.099999999999994 110.288 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.433 ' CG ' ' H ' ' A' ' 54' ' ' GLN . 4.5 t70 69.34 -174.4 0.19 Allowed 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.871 0.732 . . . . 72.120000000000005 111.934 173.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.433 ' H ' ' CG ' ' A' ' 53' ' ' ASP . 54.3 tp60 -111.3 -30.46 7.42 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.854 -0.612 . . . . 75.010000000000005 110.279 -175.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' ' 56' ' ' MET . 4.4 t30 73.32 -44.89 0.6 Allowed 'General case' 0 N--CA 1.473 0.718 0 O-C-N 124.004 0.815 . . . . 73.450000000000003 110.919 -175.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.412 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 24.6 mmt 73.72 160.15 0.23 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.815 0.846 . . . . 62.229999999999997 111.244 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.9 m -83.95 89.47 7.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.427 0.632 . . . . 75.299999999999997 109.336 174.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.5 tt -75.6 135.21 27.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.298 -0.864 . . . . 70.329999999999998 112.199 -171.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 46.1 tp -125.22 -53.54 1.61 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.954 -1.128 . . . . 75.510000000000005 107.954 171.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -121.48 130.41 53.54 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.441 -0.948 . . . . 75.099999999999994 108.441 169.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -112.56 131.66 10.27 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.555 -0.831 . . . . 65.230000000000004 112.809 -175.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 27.2 t -166.74 146.43 5.65 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 110.231 -0.285 . . . . 73.040000000000006 110.231 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.4 mt 65.34 -173.72 0.18 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.789 0.681 . . . . 73.319999999999993 111.791 176.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -128.08 118.53 2.87 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.507 -1.037 . . . . 22.440000000000001 110.507 172.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.513 HG21 HG13 ' A' ' 66' ' ' ILE . 25.3 m -104.57 -7.18 9.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 117.012 0.406 . . . . 74.239999999999995 111.553 -175.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.513 HG13 HG21 ' A' ' 65' ' ' VAL . 74.3 mt -122.41 124.41 26.81 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 116.17 -0.468 . . . . 43.350000000000001 110.451 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.637 ' HA ' ' HA ' ' A' ' 30' ' ' ASN . 10.4 Cg_exo -71.7 86.21 0.89 Allowed 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.72 2.28 . . . . 74.5 111.231 174.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.606 ' HB3' HD11 ' A' ' 35' ' ' LEU . 12.7 tpp180 -93.99 135.47 35.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.513 0.673 . . . . 75.310000000000002 110.952 -175.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.454 ' HD2' ' OE1' ' A' ' 25' ' ' GLU . 18.1 ptt180 -119.01 145.97 45.42 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.414 -0.812 . . . . 74.040000000000006 110.122 178.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.2 t -105.18 123.3 59.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.859 -0.609 . . . . 62.310000000000002 110.101 -177.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.602 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 9.6 mp -103.88 155.34 18.7 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.402 -0.592 . . . . 75.140000000000001 109.402 175.4 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.4 m -137.82 168.49 20.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.773 0.32 . . . . 62.130000000000003 110.399 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.43 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 27.6 m80 -73.42 160.51 31.65 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.95 -0.759 . . . . 73.519999999999996 108.95 176.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.32 -11.07 60.54 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.983 0.421 . . . . 72.409999999999997 110.849 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -91.71 -23.18 19.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.031 -0.532 . . . . 75.310000000000002 110.729 174.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.43 ' OD1' ' HB2' ' A' ' 73' ' ' HIS . 9.8 m-20 -93.76 -13.31 27.54 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.873 -0.603 . . . . 73.319999999999993 110.213 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.48 HD23 ' HB2' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -52.74 -57.08 11.29 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.639 -0.71 . . . . 74.420000000000002 111.183 -176.462 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.85 97.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.383 -0.371 . . . . 71.450000000000003 111.322 -177.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.8 -46.67 81.41 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.816 -0.706 . . . . 71.120000000000005 112.446 -177.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.51 -41.21 96.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.653 0.263 . . . . 73.310000000000002 111.413 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -60.47 -53.02 62.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.338 -0.392 . . . . 73.439999999999998 111.241 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -64.34 -32.62 74.3 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.704 0.261 . . . . 63.100000000000001 111.704 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.59 -54.65 32.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.783 0.325 . . . . 71.200000000000003 110.707 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.52 HD21 HG11 ' A' ' 38' ' ' VAL . 11.3 mp -65.46 -31.71 72.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 73.540000000000006 111.442 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.734 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 85.7 m -64.31 -46.28 84.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.739 0.304 . . . . 53.539999999999999 110.782 178.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.73 -29.79 69.11 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.036 0.446 . . . . 71.019999999999996 110.457 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.3 -14.79 60.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.183 -0.462 . . . . 74.230000000000004 111.131 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.64 9.57 66.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.798 -0.715 . . . . 73.099999999999994 112.415 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 79.9 mt -96.88 14.29 25.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.917 0.389 . . . . 71.549999999999997 110.727 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.769 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -71.57 80.6 0.81 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.035 -0.529 . . . . 52.119999999999997 110.668 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -134.96 -58.12 0.81 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.939 -0.573 . . . . 74.340000000000003 109.883 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.53 ' O ' ' HG3' ' A' ' 94' ' ' ARG . 77.0 mm-40 -90.67 7.84 37.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.221 -0.445 . . . . 74.299999999999997 111.751 -178.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.769 HD13 ' HA ' ' A' ' 90' ' ' ALA . 10.8 mp -61.29 118.94 7.55 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.811 -0.44 . . . . 71.129999999999995 109.811 176.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 92' ' ' GLU . 58.0 mtt180 -121.34 135.58 55.07 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.566 0.698 . . . . 75.329999999999998 112.417 -172.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.7 m -156.48 81.12 0.97 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.595 -1.261 . . . . 71.239999999999995 107.595 173.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -85.65 126.39 33.89 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.797 -0.638 . . . . 63.350000000000001 111.63 -168.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.354 -0.831 . . . . 74.329999999999998 109.048 175.558 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.479 1.024 0 CA-C-O 120.883 0.373 . . . . 64.310000000000002 110.416 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.02 130.16 5.36 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.868 -0.682 . . . . 74.319999999999993 111.879 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.0 p -121.69 -171.81 2.3 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.937 -0.394 . . . . 73.319999999999993 109.937 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.7 t -143.02 130.81 21.48 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.877 -0.416 . . . . 64.099999999999994 109.877 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -75.86 140.29 42.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.274 -0.421 . . . . 74.120000000000005 110.058 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -88.34 124.01 33.49 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.922 0.392 . . . . 73.329999999999998 111.275 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -146.55 166.3 26.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 74.129999999999995 110.355 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.1 p-80 -170.45 152.59 4.02 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.372 -0.603 . . . . 75.239999999999995 109.372 175.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -151.09 126.7 10.17 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.205 0.526 . . . . 73.019999999999996 111.801 -178.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -135.02 136.39 42.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.677 -0.692 . . . . 73.439999999999998 109.538 172.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.8 m -126.9 107.21 9.89 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.848 0.356 . . . . 73.230000000000004 110.579 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.0 m -110.66 112.3 24.09 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.153 -0.476 . . . . 73.299999999999997 110.531 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 155.63 142.43 3.43 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.506 -0.854 . . . . 74.530000000000001 112.816 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 14' ' ' ARG . 37.3 ttm180 -129.53 134.33 47.71 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.661 -0.496 . . . . 75.120000000000005 109.661 175.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -140.33 94.72 2.77 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.048 0.451 . . . . 75.430000000000007 110.922 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -135.97 17.16 3.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 72.219999999999999 110.615 177.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.428 ' C ' ' H ' ' A' ' 19' ' ' PHE . 39.6 tp -76.37 136.46 39.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.272 -0.422 . . . . 71.150000000000006 110.118 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 74.2 -13.71 0.76 Allowed 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.896 0.747 . . . . 75.120000000000005 111.535 -178.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.428 ' H ' ' C ' ' A' ' 17' ' ' LEU . 85.0 t80 -70.86 -36.55 72.87 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.442 -0.577 . . . . 74.230000000000004 109.442 174.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -67.47 118.86 11.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.05 -0.977 . . . . 63.119999999999997 110.717 176.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 177.68 -18.73 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.691 -0.766 . . . . 70.5 113.214 177.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -122.19 -136.28 0.31 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.254 0.527 . . . . 73.519999999999996 110.249 -175.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . 6.0 mp -125.09 144.75 50.26 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.709 -0.478 . . . . 75.019999999999996 109.709 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.9 mmt180 -123.98 155.03 38.96 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.889 -0.411 . . . . 71.030000000000001 109.889 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -62.67 111.29 2.02 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 121.201 0.524 . . . . 73.099999999999994 110.813 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.6 tp -80.99 -23.03 39.01 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.166 -0.925 . . . . 72.109999999999999 108.809 175.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.48 ' HA ' ' HA ' ' A' ' 94' ' ' ARG . 0.7 OUTLIER 179.18 162.17 0.8 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.011 -0.995 . . . . 71.049999999999997 109.524 176.898 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -149.19 147.53 28.54 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.467 -0.568 . . . . 72.129999999999995 109.467 -179.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.4 t -170.1 169.36 7.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.979 0.419 . . . . 61.399999999999999 110.56 178.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -97.08 -8.8 29.38 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.909 -0.587 . . . . 74.450000000000003 110.678 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -82.28 148.54 28.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.375 -0.375 . . . . 74.329999999999998 110.625 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.63 -9.8 14.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.52 -0.309 . . . . 60.329999999999998 111.514 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.1 t -79.05 -43.53 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.289 0.566 . . . . 74.420000000000002 111.012 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.601 HD22 HD11 ' A' ' 89' ' ' LEU . 39.5 tp -70.1 -41.05 74.52 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.805 -0.634 . . . . 53.340000000000003 110.741 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.448 ' CD1' ' HB3' ' A' ' 68' ' ' ARG . 68.2 mt -64.87 -36.2 83.57 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.126 0.417 . . . . 73.329999999999998 112.126 -174.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.0 p -66.76 -29.7 69.73 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.99 0.424 . . . . 63.439999999999998 110.575 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -73.38 -42.95 61.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.452 . . . . 74.349999999999994 110.108 176.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.499 HG21 ' O ' ' A' ' 34' ' ' LEU . 61.6 t -57.3 -41.97 79.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.716 -0.675 . . . . 74.329999999999998 110.408 176.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -56.61 -50.59 62.12 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.41 -0.814 . . . . 74.430000000000007 112.305 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.94 -34.29 71.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.74 0.305 . . . . 73.0 111.406 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 83.5 mt -67.19 -46.46 73.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.111 0.482 . . . . 72.439999999999998 110.174 178.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.9 mt -69.12 -31.69 70.55 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.879 -0.601 . . . . 72.209999999999994 111.162 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -71.07 -38.72 72.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.266 -0.425 . . . . 61.130000000000003 110.081 175.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.01 -43.01 94.37 Favored Glycine 0 C--N 1.332 0.338 0 CA-C-N 115.956 -0.566 . . . . 74.420000000000002 112.452 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.4 -10.18 59.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.874 0.369 . . . . 72.409999999999997 110.66 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t70 61.92 34.65 16.75 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.386 -0.824 . . . . 73.409999999999997 110.906 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.2 mt -85.13 -29.35 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.724 0.773 . . . . 55.43 109.568 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.6 169.65 37.17 Favored Glycine 0 N--CA 1.447 -0.613 0 CA-C-N 114.987 -1.006 . . . . 63.219999999999999 111.595 -177.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -160.93 137.78 8.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.961 0.41 . . . . 71.430000000000007 111.954 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.469 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 2.8 tm? -109.75 103.25 12.05 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 107.755 -1.202 . . . . 70.209999999999994 107.755 168.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.588 HG13 HG21 ' A' ' 70' ' ' VAL . 3.1 m -119.53 87.84 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.516 0.674 . . . . 63.25 111.493 -174.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 97.4 mt -128.82 162.14 28.17 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.367 -0.833 . . . . 62.450000000000003 110.336 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.491 ' CG ' ' H ' ' A' ' 54' ' ' GLN . 4.4 p-10 -95.27 -97.95 0.17 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.398 -0.365 . . . . 73.140000000000001 111.616 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.834 HE21 ' HA ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -113.62 -84.03 0.6 Allowed 'General case' 0 C--N 1.327 -0.376 0 O-C-N 122.199 -0.313 . . . . 75.150000000000006 111.654 -175.666 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -167.12 157.56 11.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.432 -0.349 . . . . 73.409999999999997 110.563 -173.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.5 tpt -105.87 116.0 31.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.196 -0.456 . . . . 61.509999999999998 110.365 178.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 57.9 m -153.67 122.89 6.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.172 -0.467 . . . . 73.129999999999995 110.066 177.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 6.9 tp -72.58 109.68 4.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.727 0.775 . . . . 74.239999999999995 111.114 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 55.6 tp -140.63 155.14 46.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.581 -0.736 . . . . 73.25 109.109 178.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -73.7 107.0 5.7 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.641 0.734 . . . . 65.109999999999999 110.702 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 169.27 147.83 5.58 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.418 -1.073 . . . . 30.030000000000001 110.418 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 m -87.33 -26.93 23.14 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.964 0.382 . . . . 72.340000000000003 111.186 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.411 ' HB3' ' H ' ' A' ' 64' ' ' GLY . 10.1 mp 61.74 -157.06 0.34 Allowed 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.188 -0.46 . . . . 75.530000000000001 110.37 -178.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.411 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . 156.99 -30.76 0.54 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.474 -0.869 . . . . 73.510000000000005 112.562 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 47.5 t -81.88 106.7 13.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.918 0.389 . . . . 61.240000000000002 110.371 -179.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 49.9 mm -119.22 91.86 44.54 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 116.143 -0.48 . . . . 73.319999999999993 110.257 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -95.1 99.82 0.11 Allowed 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 123.238 2.625 . . . . 71.099999999999994 111.536 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.478 ' HA ' ' HA ' ' A' ' 53' ' ' ASP . 55.8 ttm-85 -89.32 136.31 33.09 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.908 -0.404 . . . . 74.219999999999999 109.908 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.99 141.94 46.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.239 -0.437 . . . . 75.409999999999997 110.362 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.588 HG21 HG13 ' A' ' 51' ' ' VAL . 48.1 t -102.38 106.94 20.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.663 -0.699 . . . . 74.510000000000005 109.838 177.566 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 10.3 mp -106.12 132.86 51.69 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.901 0.382 . . . . 71.439999999999998 111.103 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.3 m -120.77 155.25 24.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.307 -0.627 . . . . 65.030000000000001 109.307 173.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.422 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 7.5 t-80 -64.37 144.79 56.91 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.893 -0.41 . . . . 73.099999999999994 109.893 -178.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.499 ' HA ' HD21 ' A' ' 77' ' ' LEU . 42.6 mt-10 -71.6 69.23 0.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.299 0.571 . . . . 72.25 111.864 -176.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -141.98 -51.53 0.41 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.2 -0.909 . . . . 70.019999999999996 109.477 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -108.88 43.73 1.22 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.425 -0.807 . . . . 74.439999999999998 111.733 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.499 HD21 ' HA ' ' A' ' 74' ' ' GLU . 4.1 mm? -65.18 -52.89 52.13 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.712 -0.477 . . . . 61.009999999999998 109.712 175.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.9 -22.64 62.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.203 -0.453 . . . . 73.239999999999995 110.942 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.24 -48.05 15.92 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 121.04 -0.6 . . . . 75.120000000000005 112.017 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.04 -38.62 86.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.776 0.322 . . . . 60.109999999999999 110.467 177.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.438 HH11 ' HD2' ' A' ' 81' ' ' ARG . 21.0 mtp180 -62.1 -28.23 69.47 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.119 -0.491 . . . . 71.450000000000003 110.406 175.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -69.8 -51.1 36.69 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.497 -0.557 . . . . 73.409999999999997 109.497 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.3 tp -60.01 -51.65 68.75 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.113 -0.949 . . . . 64.230000000000004 111.631 -177.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.0 mp -63.05 -27.58 69.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 73.329999999999998 111.844 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.85 ' HA ' ' HB1' ' A' ' 90' ' ' ALA . 70.1 m -81.45 -43.24 19.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.824 0.345 . . . . 73.340000000000003 111.08 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.69 -44.14 78.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 71.310000000000002 110.881 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.09 87.86 1.22 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.227 -0.442 . . . . 73.150000000000006 110.717 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -172.47 -69.43 0.04 OUTLIER Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.447 -0.883 . . . . 33.530000000000001 111.987 176.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.679 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -164.12 -56.65 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.637 0.256 . . . . 74.400000000000006 110.937 -175.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.85 ' HB1' ' HA ' ' A' ' 85' ' ' THR . . . 60.6 13.37 4.19 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.72 -0.673 . . . . 71.340000000000003 112.168 -177.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -87.23 -40.99 14.04 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.131 -0.227 . . . . 74.450000000000003 110.992 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -93.5 -81.61 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.997 -0.281 . . . . 72.349999999999994 111.228 -177.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 96.1 mt 53.48 43.59 31.08 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.743 0.782 . . . . 71.310000000000002 109.521 -172.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.48 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 49.6 ttt180 64.31 89.15 0.09 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 113.693 -1.594 . . . . 73.349999999999994 111.048 -173.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 19.4 m -74.76 89.15 2.28 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.732 -0.84 . . . . 62.240000000000002 108.732 170.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -82.65 88.16 6.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.574 -0.739 . . . . 73.409999999999997 110.147 -173.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.7 t70 . . . . . 0 C--O 1.247 0.932 0 CA-C-N 115.35 -0.841 . . . . 75.420000000000002 110.318 -174.797 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.736 0.303 . . . . 73.150000000000006 110.326 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.12 100.41 0.29 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.784 -0.722 . . . . 70.209999999999994 112.542 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.7 t -84.8 127.68 34.25 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.312 -0.625 . . . . 73.420000000000002 109.312 177.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.6 p -120.33 101.09 7.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.203 0.525 . . . . 54.439999999999998 111.061 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -158.81 118.91 3.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.702 -0.681 . . . . 53.219999999999999 110.617 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -149.98 115.86 5.62 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.537 -0.912 . . . . 75.519999999999996 108.537 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -93.41 106.21 18.2 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.389 -0.369 . . . . 73.049999999999997 110.689 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 24.1 p-80 -104.57 113.63 27.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.421 0.629 . . . . 72.519999999999996 110.936 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -149.37 108.03 3.83 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.592 -0.731 . . . . 73.519999999999996 109.918 174.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -160.72 125.9 3.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.135 -0.484 . . . . 63.229999999999997 110.515 -177.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.4 p -155.27 86.41 1.09 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.026 -0.533 . . . . 74.019999999999996 110.281 177.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.5 m -152.46 124.81 8.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.169 -0.469 . . . . 74.519999999999996 110.79 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 140.56 97.33 0.32 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.966 -0.635 . . . . 72.340000000000003 112.285 176.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.7 ttp180 -106.73 -41.1 5.32 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.496 -0.557 . . . . 71.040000000000006 109.496 177.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 65.72 92.24 0.08 Allowed 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.364 -0.835 . . . . 74.25 111.908 175.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -143.58 -47.1 0.29 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.931 -0.577 . . . . 75.329999999999998 110.894 178.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -90.8 122.56 33.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.142 -0.481 . . . . 71.209999999999994 110.188 -174.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -80.15 97.4 6.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.838 -0.619 . . . . 74.340000000000003 110.564 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -84.81 170.31 13.3 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.079 -0.51 . . . . 71.109999999999999 110.714 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 32.8 tt0 -99.97 119.6 38.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.091 0.472 . . . . 61.5 111.092 -175.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.67 26.92 8.52 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.755 -0.736 . . . . 63.530000000000001 112.25 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.448 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 17.9 t-80 -94.01 -10.65 32.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.744 0.307 . . . . 52.509999999999998 110.228 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.448 ' HB2' ' O ' ' A' ' 22' ' ' HIS . 8.7 mp 71.93 151.14 0.1 Allowed 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.525 -0.761 . . . . 75.219999999999999 111.783 178.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -125.36 166.04 17.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.459 -0.791 . . . . 73.400000000000006 109.162 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.775 ' HG2' ' HD2' ' A' ' 69' ' ' ARG . 2.0 mp0 -77.92 124.25 27.77 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.284 -0.635 . . . . 71.400000000000006 109.284 171.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.522 ' HB3' HD21 ' A' ' 27' ' ' LEU . 1.1 tm? -77.17 -30.73 55.03 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 108.801 -0.814 . . . . 74.5 108.801 177.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.522 HD21 ' HB3' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -170.08 160.53 8.17 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.563 -0.744 . . . . 73.230000000000004 110.84 -175.197 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.505 ' HD3' ' HB3' ' A' ' 67' ' ' PRO . 6.0 tmm_? -127.56 106.48 9.2 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 107.0 -1.481 . . . . 74.439999999999998 107.0 170.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.509 HG23 HD21 ' A' ' 35' ' ' LEU . 14.6 t -78.25 164.2 25.1 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.482 0.658 . . . . 72.230000000000004 111.573 -166.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -114.7 -3.5 12.84 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.159 -0.928 . . . . 73.430000000000007 110.397 178.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -131.93 147.2 52.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.504 -0.316 . . . . 44.450000000000003 110.995 -175.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -93.74 -23.35 18.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.346 -0.388 . . . . 63.229999999999997 111.532 -175.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.0 t -79.18 -37.78 19.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.319 0.58 . . . . 71.099999999999994 110.0 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.3 tp -57.03 -32.25 65.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.413 -0.812 . . . . 72.099999999999994 111.284 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.509 HD21 HG23 ' A' ' 29' ' ' THR . 93.5 mt -56.08 -39.6 72.34 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.944 0.402 . . . . 74.409999999999997 111.446 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.4 m -64.95 -26.85 68.48 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.886 -0.597 . . . . 51.409999999999997 110.895 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.21 -47.9 10.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.267 -0.424 . . . . 61.340000000000003 110.639 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.406 ' HA ' HD11 ' A' ' 41' ' ' LEU . 86.4 t -58.58 -40.54 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.163 -0.472 . . . . 73.310000000000002 111.416 -179.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.03 -50.03 72.09 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.025 -0.607 . . . . 73.099999999999994 112.553 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.41 -27.22 69.15 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.895 0.378 . . . . 71.209999999999994 111.295 -177.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.427 ' HB3' HD23 ' A' ' 83' ' ' LEU . 91.9 mt -69.82 -51.66 31.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.966 -0.561 . . . . 75.25 110.168 177.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.4 mt -65.44 -40.21 93.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.669 -0.696 . . . . 54.130000000000003 110.919 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -64.63 -47.56 78.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.993 0.425 . . . . 75.209999999999994 110.662 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.09 -25.75 75.18 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.984 -0.627 . . . . 44.340000000000003 113.058 -176.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.74 1.63 56.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.681 0.241 . . . . 61.549999999999997 111.46 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.2 t70 64.86 33.19 10.28 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 122.001 0.905 . . . . 71.25 110.287 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.784 HG21 ' HB3' ' A' ' 76' ' ' ASP . 71.5 mt -88.25 128.27 40.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.353 -0.839 . . . . 73.140000000000001 110.394 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.69 99.16 0.9 Allowed Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.812 -0.515 . . . . 44.109999999999999 111.812 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -122.7 152.52 40.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.778 0.323 . . . . 70.010000000000005 110.887 -173.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.0 tp -129.03 104.8 7.78 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.873 -0.603 . . . . 43.43 110.159 177.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.3 m -129.63 112.29 24.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.095 -0.502 . . . . 65.450000000000003 110.708 177.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 pp -147.2 149.56 33.18 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.339 -0.392 . . . . 71.319999999999993 111.266 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -179.36 -160.7 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.127 -1.064 . . . . 74.319999999999993 108.127 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -122.63 127.86 49.91 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.888 -0.412 . . . . 73.109999999999999 109.888 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -78.16 137.44 38.17 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.43 -0.581 . . . . 75.230000000000004 109.43 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 54.6 ttp -49.56 -70.4 0.09 Allowed 'General case' 0 C--N 1.332 -0.177 0 O-C-N 123.713 0.633 . . . . 61.420000000000002 110.994 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.6 t 174.45 151.71 0.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 123.879 0.737 . . . . 74.129999999999995 109.4 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 14.3 tt -90.34 -13.93 9.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.64 0.733 . . . . 75.209999999999994 109.117 172.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 tp -101.57 98.9 9.16 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.332 -0.849 . . . . 73.400000000000006 110.333 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 68.34 -166.88 0.19 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.315 -0.857 . . . . 71.340000000000003 111.245 176.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.34 128.28 6.33 Favored Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.247 -0.741 . . . . 73.519999999999996 111.247 -174.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 31.5 m -72.09 -74.45 0.16 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.75 0.275 . . . . 71.25 111.004 -175.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 80.2 mt -135.29 119.0 17.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.923 0.392 . . . . 71.049999999999997 110.717 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.3 71.68 1.38 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.932 -0.652 . . . . 63.210000000000001 111.916 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.5 t -81.29 84.36 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.175 0.512 . . . . 72.140000000000001 110.743 -178.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 mp -110.79 112.47 56.02 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.694 -0.685 . . . . 74.099999999999994 109.588 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.505 ' HB3' ' HD3' ' A' ' 28' ' ' ARG . 22.3 Cg_exo -64.96 108.2 1.06 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.579 2.186 . . . . 72.340000000000003 111.308 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.523 ' HA ' ' CZ ' ' A' ' 68' ' ' ARG . 0.7 OUTLIER -97.35 138.11 35.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.219 -0.446 . . . . 74.230000000000004 110.723 -177.305 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.775 ' HD2' ' HG2' ' A' ' 25' ' ' GLU . 81.9 mtm180 -113.55 133.54 55.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.994 -0.548 . . . . 73.450000000000003 109.865 178.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.2 t -103.62 114.93 44.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.518 -0.549 . . . . 73.310000000000002 109.518 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.438 ' CD1' ' HG3' ' A' ' 25' ' ' GLU . 10.1 mp -103.59 144.18 31.77 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.851 0.358 . . . . 73.5 111.143 -177.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.478 HG23 HD21 ' A' ' 77' ' ' LEU . 26.2 m -141.5 167.27 16.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.682 -0.69 . . . . 75.450000000000003 109.811 176.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.507 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 14.1 m-70 -74.8 162.87 28.28 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.21 -0.663 . . . . 74.340000000000003 109.21 176.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.526 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 17.5 mt-10 -71.17 -18.62 62.48 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.214 -0.662 . . . . 74.409999999999997 109.214 174.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -66.87 -37.79 85.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.266 -0.879 . . . . 72.230000000000004 109.624 172.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.784 ' HB3' HG21 ' A' ' 47' ' ' ILE . 8.5 m-20 -97.45 -4.86 37.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.057 -0.974 . . . . 73.140000000000001 110.505 -175.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.615 ' O ' ' HG3' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -53.24 -58.26 7.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.837 -0.62 . . . . 73.219999999999999 111.233 -172.1 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.84 -32.72 72.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.801 0.334 . . . . 63.229999999999997 111.232 -177.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.76 -47.17 91.17 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.81 -0.709 . . . . 62.43 112.055 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.58 -40.8 80.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.504 0.193 . . . . 55.210000000000001 110.837 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.615 ' HG3' ' O ' ' A' ' 77' ' ' LEU . 21.0 mtp180 -57.36 -53.88 53.13 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.416 -0.357 . . . . 74.530000000000001 110.969 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -67.24 -37.55 83.71 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.833 -0.347 . . . . 71.430000000000007 110.864 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.427 HD23 ' HB3' ' A' ' 41' ' ' LEU . 60.6 tp -58.89 -54.94 41.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.072 0.463 . . . . 64.310000000000002 110.773 179.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.9 mt -66.09 -27.62 68.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.794 -0.639 . . . . 71.340000000000003 111.724 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.782 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 69.0 m -79.37 -42.7 24.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.768 0.318 . . . . 51.409999999999997 111.0 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.96 -43.91 70.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.997 -0.547 . . . . 62.100000000000001 112.261 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.49 23.72 4.39 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.397 0.517 . . . . 43.210000000000001 112.397 -175.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -121.01 -84.01 0.76 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.03 -1.081 . . . . 73.5 111.517 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.535 HD12 ' N ' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -178.35 -31.84 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.48 -0.36 . . . . 70.120000000000005 111.514 -175.832 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.782 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 59.36 24.58 13.16 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.818 0.342 . . . . 72.510000000000005 111.686 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . 0.406 ' H ' ' CD1' ' A' ' 89' ' ' LEU . 45.0 t60 -89.98 -22.76 21.76 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.337 -0.392 . . . . 71.129999999999995 111.164 -175.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -92.69 -8.32 44.3 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.291 -0.413 . . . . 63.140000000000001 111.686 -173.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.677 HD11 ' HA ' ' A' ' 90' ' ' ALA . 7.5 mp -70.42 94.59 0.97 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.148 0.499 . . . . 73.040000000000006 110.696 -176.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -137.7 27.45 2.74 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.757 -0.656 . . . . 74.430000000000007 111.739 -174.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 38.2 m -132.88 20.52 4.15 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.295 0.569 . . . . 64.140000000000001 110.893 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -92.45 116.5 29.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.717 -0.674 . . . . 64.400000000000006 111.055 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.6 t70 . . . . . 0 C--O 1.251 1.166 0 CA-C-N 115.817 -0.628 . . . . 75.200000000000003 109.866 176.438 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 mmt . . . . . 0 N--CA 1.482 1.139 0 CA-C-O 120.695 0.284 . . . . 74.439999999999998 110.263 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 118.91 112.81 2.49 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.882 -0.675 . . . . 71.049999999999997 112.128 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.7 t -128.96 95.74 4.16 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.981 0.42 . . . . 72.129999999999995 109.951 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.0 m -147.84 147.9 30.29 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.653 -0.703 . . . . 73.400000000000006 109.669 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -137.37 105.68 5.76 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.297 0.57 . . . . 73.409999999999997 110.698 178.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -102.62 119.59 39.09 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.781 -0.645 . . . . 74.519999999999996 109.868 177.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -71.9 87.84 1.02 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.21 -0.45 . . . . 70.400000000000006 110.064 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -75.99 150.3 37.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.065 -0.516 . . . . 73.319999999999993 110.851 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -171.2 101.83 0.21 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.127 -0.488 . . . . 71.409999999999997 110.182 176.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -100.03 152.55 20.08 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.184 -0.462 . . . . 73.209999999999994 110.034 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.2 p -84.87 164.63 18.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.348 -0.387 . . . . 75.129999999999995 110.792 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.3 m -114.22 121.18 42.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.918 0.39 . . . . 62.109999999999999 110.505 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -170.56 103.41 0.19 Allowed Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.294 -0.722 . . . . 44.109999999999999 111.294 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.8 ptt180 -119.17 141.64 48.67 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.933 0.397 . . . . 74.329999999999998 110.919 -176.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.39 121.58 15.85 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.784 -0.644 . . . . 75.109999999999999 109.594 178.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -150.68 94.6 2.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.458 -0.337 . . . . 72.239999999999995 110.889 -176.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.0 mp -135.58 91.68 2.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.35 -0.386 . . . . 73.420000000000002 110.755 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -105.41 109.7 21.77 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.34 -0.615 . . . . 75.25 109.34 172.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -66.89 -55.17 15.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.198 -0.455 . . . . 74.120000000000005 111.256 -174.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -107.86 134.4 50.85 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.878 0.37 . . . . 72.439999999999998 110.794 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.34 64.48 0.28 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 121.015 -0.612 . . . . 61.149999999999999 112.003 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -130.17 57.69 1.69 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.104 -0.702 . . . . 73.340000000000003 109.104 178.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.1 mt 67.99 168.12 0.26 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.169 -0.923 . . . . 64.340000000000003 110.508 -175.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.7 ' HB3' HD21 ' A' ' 77' ' ' LEU . 0.6 OUTLIER -143.84 127.19 16.77 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.766 -0.457 . . . . 74.319999999999993 109.766 -178.63 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.714 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 24.8 tt0 -68.38 117.87 10.72 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.096 -0.502 . . . . 74.540000000000006 109.646 178.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.705 HD13 HD21 ' A' ' 27' ' ' LEU . 2.7 tm? -93.64 -61.18 1.6 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.233 -0.44 . . . . 74.219999999999999 111.292 -171.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.705 HD21 HD13 ' A' ' 26' ' ' LEU . 2.6 pp -142.25 161.7 37.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.779 0.323 . . . . 71.540000000000006 111.063 -173.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -134.94 135.87 41.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.686 -0.688 . . . . 74.510000000000005 110.038 178.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.4 t -144.61 176.41 9.43 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.019 0.438 . . . . 74.549999999999997 110.943 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -117.72 -11.31 10.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.982 -0.553 . . . . 75.329999999999998 110.103 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.431 ' HA ' HD13 ' A' ' 63' ' ' LEU . 19.0 t70 -102.61 153.96 19.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.753 -0.658 . . . . 72.140000000000001 110.768 -176.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -111.59 -11.28 14.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.252 -0.431 . . . . 54.240000000000002 111.239 -178.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.9 t -78.52 -43.93 26.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.918 0.39 . . . . 73.140000000000001 110.482 -178.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.657 HD22 HD13 ' A' ' 89' ' ' LEU . 66.1 tp -60.32 -31.6 70.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.891 -0.595 . . . . 73.120000000000005 110.797 177.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 77.6 mt -62.4 -22.64 66.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.583 -0.735 . . . . 71.510000000000005 111.754 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.3 m -60.83 -45.03 96.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.846 0.355 . . . . 53.140000000000001 110.362 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.506 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -68.06 -41.61 81.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.289 -0.414 . . . . 72.299999999999997 110.616 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 56.8 t -60.02 -45.35 95.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.94 -0.573 . . . . 73.230000000000004 110.27 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.44 -44.62 96.47 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.602 -0.726 . . . . 63.140000000000001 112.151 -179.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.36 -33.62 72.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.852 0.358 . . . . 72.129999999999995 110.986 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 91.2 mt -72.09 -47.77 48.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.13 -0.486 . . . . 62.210000000000001 110.7 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 91.4 mt -65.72 -47.42 75.39 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.113 -0.494 . . . . 60.43 110.809 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -42.27 98.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 74.319999999999993 110.836 178.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.32 -35.56 87.95 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.231 -0.509 . . . . 71.450000000000003 112.868 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.84 -0.01 55.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.619 0.247 . . . . 72.519999999999996 111.095 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.5 t70 61.38 35.76 17.74 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.999 0.904 . . . . 71.239999999999995 110.232 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.685 HG21 ' HB3' ' A' ' 76' ' ' ASP . 64.9 mt -88.8 119.73 36.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.156 -0.929 . . . . 74.030000000000001 110.57 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.82 137.0 46.98 Favored Glycine 0 C--N 1.332 0.307 0 N-CA-C 111.528 -0.629 . . . . 61.229999999999997 111.528 175.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 38.9 p-80 -152.56 138.57 18.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.114 0.483 . . . . 73.540000000000006 111.68 -171.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.0 tt -126.87 103.93 7.77 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.503 -0.771 . . . . 62.549999999999997 109.163 177.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.4 t -80.86 117.85 27.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.85 -0.426 . . . . 63.140000000000001 109.85 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -93.2 100.67 13.0 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.192 0.52 . . . . 74.420000000000002 110.243 -177.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -127.62 162.5 26.35 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.511 -0.922 . . . . 73.319999999999993 108.511 171.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.572 ' H ' HG23 ' A' ' 66' ' ' ILE . 26.2 tt0 -119.63 96.25 5.12 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.033 0.444 . . . . 73.010000000000005 110.4 -177.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -88.8 97.08 10.95 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.047 -0.524 . . . . 71.019999999999996 109.78 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 85.2 mtp -91.1 -169.99 2.52 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.829 -0.623 . . . . 64.549999999999997 110.456 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.1 m -61.04 156.29 18.23 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.789 -0.448 . . . . 74.510000000000005 109.789 174.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 7.1 tp -60.14 114.63 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.384 0.611 . . . . 73.099999999999994 111.275 -175.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 51.5 tp -151.69 155.06 37.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.503 -0.771 . . . . 73.409999999999997 109.003 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -66.87 126.86 30.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.1 0.476 . . . . 72.409999999999997 111.027 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.52 100.09 2.4 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.814 -0.707 . . . . 74.310000000000002 112.255 178.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.466 ' HA ' HD12 ' A' ' 66' ' ' ILE . 47.3 t -129.8 -46.92 1.15 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.866 0.365 . . . . 72.439999999999998 110.429 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.431 HD13 ' HA ' ' A' ' 31' ' ' ASP . 24.9 tp -86.71 125.97 34.25 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.544 -0.539 . . . . 75.420000000000002 109.544 -178.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.82 -45.53 3.49 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.938 -0.649 . . . . 71.510000000000005 111.908 -176.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -62.15 -36.04 72.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-O 121.178 0.513 . . . . 63.240000000000002 110.872 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.572 HG23 ' H ' ' A' ' 54' ' ' GLN . 3.5 mp -111.8 111.08 54.27 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 115.795 -0.639 . . . . 71.430000000000007 109.506 173.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -65.09 132.57 32.37 Favored 'Trans proline' 0 N--CA 1.463 -0.269 0 C-N-CA 122.518 2.145 . . . . 73.450000000000003 112.0 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 29.0 mmt-85 -101.84 113.33 26.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.192 -0.458 . . . . 75.519999999999996 109.838 -178.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -124.93 142.31 51.55 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.223 -0.591 . . . . 71.439999999999998 110.934 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.8 t -108.85 125.35 65.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.593 -0.73 . . . . 71.120000000000005 110.756 -174.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.714 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.0 mp -106.23 142.76 35.39 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.546 -0.538 . . . . 72.030000000000001 109.546 174.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.8 m -132.12 -178.41 2.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 109.847 -0.427 . . . . 62.310000000000002 109.847 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.575 ' HB2' ' HB2' ' A' ' 76' ' ' ASP . 24.9 m170 -68.49 158.12 34.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.817 0.341 . . . . 74.230000000000004 110.724 177.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -38.78 84.39 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.221 -0.659 . . . . 73.030000000000001 109.221 174.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -73.4 -39.93 64.7 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.972 -1.013 . . . . 73.120000000000005 110.855 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.685 ' HB3' HG21 ' A' ' 47' ' ' ILE . 9.7 m-20 -78.34 -8.91 58.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.8 -0.636 . . . . 52.119999999999997 111.132 -178.391 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.75 HD13 ' HD3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -54.51 -46.2 73.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.041 0.448 . . . . 63.310000000000002 109.864 179.328 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.59 -36.64 79.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.506 -0.77 . . . . 63.119999999999997 111.357 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -78.49 -46.51 8.79 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.365 -0.921 . . . . 72.340000000000003 112.157 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.96 -47.9 73.08 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.911 0.337 . . . . 71.530000000000001 111.911 -175.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.75 ' HD3' HD13 ' A' ' 77' ' ' LEU . 15.5 ptt180 -68.56 -22.39 64.49 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.6 -0.44 . . . . 72.450000000000003 110.674 -176.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.4 ttp85 -78.2 -48.72 15.22 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.935 -0.395 . . . . 74.530000000000001 109.935 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 41.4 tp -59.56 -50.36 74.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.602 -0.726 . . . . 71.239999999999995 111.355 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.99 -27.87 68.47 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.929 -0.578 . . . . 73.25 111.917 -177.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.986 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 98.7 m -82.37 -37.35 25.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.791 0.329 . . . . 72.109999999999999 111.277 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -74.42 -44.69 50.73 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.944 0.349 . . . . 55.43 111.944 -176.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -142.95 35.65 1.39 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 111.851 0.315 . . . . 74.239999999999995 111.851 -174.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -124.63 -79.35 0.39 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.009 -1.091 . . . . 60.409999999999997 112.542 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.701 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -157.62 -56.66 0.08 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.756 0.313 . . . . 65.140000000000001 110.369 -175.099 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.986 ' HB3' ' HA ' ' A' ' 85' ' ' THR . . . 63.75 12.71 6.87 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.421 -0.809 . . . . 74.230000000000004 112.703 177.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -105.39 -26.56 11.91 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.334 -0.547 . . . . 74.319999999999993 111.191 -176.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 28' ' ' ARG . 13.5 mm-40 -97.84 -3.21 39.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.087 0.47 . . . . 51.43 110.758 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.652 HD11 ' HA ' ' A' ' 90' ' ' ALA . 9.7 mp -73.21 135.31 44.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.148 -0.478 . . . . 73.530000000000001 110.636 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -156.86 91.3 1.2 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.326 0.584 . . . . 75.329999999999998 110.581 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.7 m -109.26 64.21 0.61 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.065 -0.717 . . . . 61.409999999999997 109.065 175.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 65.36 14.17 9.27 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.429 -0.805 . . . . 73.439999999999998 110.061 -172.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.9 t70 . . . . . 0 C--O 1.25 1.126 0 CA-C-N 114.53 -1.214 . . . . 74.010000000000005 108.938 178.768 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ttt . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 120.889 0.376 . . . . 71.140000000000001 110.22 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 156.49 155.09 7.27 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 111.368 -0.693 . . . . 44.109999999999999 111.368 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.5 m -153.49 92.89 1.63 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.96 0.41 . . . . 70.329999999999998 110.639 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.2 p -107.83 66.93 0.67 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.453 0.644 . . . . 50.119999999999997 110.327 178.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -156.14 131.35 9.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.329 -0.85 . . . . 72.519999999999996 109.475 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -148.36 152.97 37.95 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.53 -0.304 . . . . 70.319999999999993 110.891 -177.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.6 t-80 -156.53 81.25 0.96 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.491 -0.559 . . . . 74.049999999999997 109.491 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -154.78 76.69 1.01 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.055 -0.52 . . . . 74.409999999999997 110.475 -175.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -177.11 114.17 0.09 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.349 -0.387 . . . . 65.340000000000003 110.962 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -163.58 17.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.026 0.441 . . . . 74.209999999999994 110.618 170.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.9 m -79.97 106.69 12.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.378 -0.373 . . . . 72.400000000000006 110.433 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.0 m -158.07 130.43 7.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.204 -0.453 . . . . 74.340000000000003 110.516 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 123.62 50.7 0.21 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.223 -0.989 . . . . 71.409999999999997 113.261 175.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -102.09 88.89 3.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.955 0.407 . . . . 75.109999999999999 110.512 174.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -123.62 -5.15 8.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.875 -0.602 . . . . 64.519999999999996 110.662 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.406 ' N ' HD21 ' A' ' 16' ' ' ASN . 0.9 OUTLIER -90.29 101.03 13.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.285 -0.416 . . . . 73.530000000000001 110.082 176.862 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -134.91 104.27 5.92 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.014 -0.735 . . . . 71.329999999999998 109.014 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 43.3 p90 -148.14 143.77 27.33 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.924 -0.58 . . . . 74.150000000000006 110.123 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -140.74 136.91 33.02 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.931 -0.577 . . . . 71.329999999999998 109.796 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -129.0 -34.88 1.88 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.355 0.598 . . . . 72.129999999999995 109.58 178.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.18 26.37 8.36 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.368 -0.833 . . . . 43.310000000000002 111.045 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -113.62 165.12 12.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.805 0.336 . . . . 74.439999999999998 110.781 -173.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.1 mp -99.03 157.85 16.06 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.679 -0.489 . . . . 73.239999999999995 109.679 175.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 ttt180 -134.52 133.31 40.19 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.78 -0.452 . . . . 74.319999999999993 109.78 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.553 ' CA ' ' HG ' ' A' ' 71' ' ' LEU . 1.8 pt-20 -73.28 127.7 33.38 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.097 -0.705 . . . . 71.519999999999996 109.097 -179.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 45.3 tp -104.54 -29.84 10.4 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.579 -0.737 . . . . 72.409999999999997 111.132 -171.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -163.73 158.67 20.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.045 0.45 . . . . 75.129999999999995 111.253 -176.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -145.8 128.33 16.04 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.567 -0.901 . . . . 73.400000000000006 108.567 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.5 t -143.09 162.15 36.29 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.391 0.615 . . . . 73.329999999999998 111.698 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -106.77 2.03 25.33 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.256 -0.884 . . . . 65.5 110.414 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -96.54 119.9 35.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.981 -0.554 . . . . 75.319999999999993 109.822 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.32 -45.94 68.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.181 -0.463 . . . . 74.019999999999996 111.981 -174.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.2 t -66.51 -46.63 85.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.396 -0.365 . . . . 64.519999999999996 111.009 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.8 tp -61.59 -41.5 97.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.766 0.317 . . . . 71.140000000000001 110.396 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 68' ' ' ARG . 4.7 tt -59.46 -44.55 92.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.937 -0.574 . . . . 73.310000000000002 110.011 177.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.8 m -65.31 -41.54 93.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.868 -0.605 . . . . 71.319999999999993 110.711 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.417 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -62.01 -51.87 66.27 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.084 -0.507 . . . . 61.310000000000002 111.087 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.439 ' HA ' HD11 ' A' ' 41' ' ' LEU . 99.2 t -63.81 -40.46 89.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.089 0.471 . . . . 74.409999999999997 110.927 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.34 -42.24 99.72 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.796 -0.638 . . . . 72.430000000000007 112.297 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.08 -34.03 77.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.805 0.336 . . . . 63.0 110.825 178.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.543 ' HB3' HD23 ' A' ' 83' ' ' LEU . 97.8 mt -62.43 -49.1 76.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.285 0.564 . . . . 73.510000000000005 110.5 177.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.527 HD12 HG13 ' A' ' 70' ' ' VAL . 75.3 mt -70.94 -42.53 69.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.578 -0.737 . . . . 63.310000000000002 111.044 -176.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -67.13 -35.53 79.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.953 0.406 . . . . 64.430000000000007 110.627 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.1 -23.05 72.87 Favored Glycine 0 C--O 1.229 -0.194 0 C-N-CA 121.027 -0.606 . . . . 64.129999999999995 112.281 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.19 11.78 20.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.929 0.395 . . . . 61.299999999999997 110.528 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.0 t70 68.63 6.26 5.37 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.309 -0.86 . . . . 72.340000000000003 111.294 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 60.6 mt -73.6 -24.19 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.648 0.737 . . . . 61.43 109.042 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.05 -153.43 51.16 Favored Glycine 0 N--CA 1.441 -1.014 0 CA-C-N 114.779 -1.1 . . . . 55.030000000000001 111.573 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -173.15 143.39 1.12 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.654 0.264 . . . . 75.340000000000003 110.702 176.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.878 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 41.8 tp -108.45 88.28 2.69 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 108.781 -0.822 . . . . 62.210000000000001 108.781 168.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.523 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 24.0 m -108.0 25.21 2.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.974 0.893 . . . . 54.43 109.644 -178.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 39.1 tp -110.94 80.18 1.28 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.817 -1.083 . . . . 72.439999999999998 110.468 -173.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.402 ' HB3' ' H ' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -107.34 -152.52 0.48 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.344 -0.844 . . . . 61.140000000000001 109.713 175.646 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.402 ' H ' ' HB3' ' A' ' 53' ' ' ASP . 58.1 tt0 -64.58 112.52 3.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.071 0.462 . . . . 72.329999999999998 110.996 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -98.86 172.37 7.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.742 -0.663 . . . . 74.219999999999999 110.809 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.437 ' SD ' ' N ' ' A' ' 57' ' ' SER . 0.0 OUTLIER -153.07 161.38 42.56 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.092 -1.077 . . . . 71.030000000000001 108.092 178.793 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.437 ' N ' ' SD ' ' A' ' 56' ' ' MET . 3.8 m -62.01 -82.24 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.871 0.367 . . . . 64.329999999999998 111.31 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 5.3 mp -134.78 -49.91 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 75.329999999999998 109.949 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.41 ' C ' ' H ' ' A' ' 61' ' ' GLY . 1.4 tt 59.76 66.41 1.0 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.376 -0.829 . . . . 73.430000000000007 110.132 -177.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 71.08 -35.17 0.32 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.741 0.816 . . . . 73.299999999999997 112.805 177.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.41 ' H ' ' C ' ' A' ' 59' ' ' LEU . . . 87.91 70.43 1.28 Allowed Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.787 -0.72 . . . . 74.219999999999999 111.572 -179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 39.5 m -148.52 -62.58 0.25 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.818 0.342 . . . . 65.409999999999997 110.705 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 50.8 tp -147.72 145.15 28.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.469 . . . . 74.310000000000002 110.387 -176.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -89.06 131.99 11.0 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.743 -0.741 . . . . 72.319999999999993 111.587 176.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.5 t -65.62 -40.85 89.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.387 0.613 . . . . 74.120000000000005 110.262 -179.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 50.4 mm -107.7 103.78 50.58 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.24 -0.891 . . . . 64.010000000000005 109.591 176.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -62.23 124.69 14.8 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.619 2.213 . . . . 72.450000000000003 111.421 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.431 ' HB3' HD12 ' A' ' 35' ' ' LEU . 50.3 ttm-85 -62.03 136.91 58.16 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.058 -0.519 . . . . 73.519999999999996 109.997 -178.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.523 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 32.0 ptt180 -122.18 157.59 31.23 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.444 -0.343 . . . . 73.340000000000003 110.476 -175.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.527 HG13 HD12 ' A' ' 42' ' ' LEU . 24.7 t -112.53 116.32 52.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.833 -0.621 . . . . 63.009999999999998 110.393 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.878 ' HB2' ' HB3' ' A' ' 50' ' ' LEU . 8.9 mp -101.99 129.58 48.32 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.08 -0.509 . . . . 71.140000000000001 110.288 176.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 29.5 m -108.94 -173.68 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.585 -0.734 . . . . 65.209999999999994 109.571 177.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -97.59 143.71 28.0 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.839 -0.344 . . . . 74.019999999999996 110.621 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -40.19 -54.61 2.3 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.373 1.249 . . . . 54.43 114.373 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -80.8 -19.07 45.53 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.063 0.458 . . . . 73.450000000000003 111.196 -171.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -83.2 2.24 36.66 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.832 -0.622 . . . . 75.430000000000007 110.783 -177.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -54.89 -44.65 74.31 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.424 -0.353 . . . . 61.100000000000001 110.673 176.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.37 83.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.99 -0.55 . . . . 64.109999999999999 111.177 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -69.1 -46.7 57.48 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.661 -0.781 . . . . 41.310000000000002 111.862 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.21 96.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.681 -0.259 . . . . 73.219999999999999 111.582 -178.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 55.2 mtp85 -59.0 -48.64 80.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.998 -0.547 . . . . 64.409999999999997 111.357 -178.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -64.58 -45.69 85.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.989 0.423 . . . . 65.400000000000006 110.564 179.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.543 HD23 ' HB3' ' A' ' 41' ' ' LEU . 59.4 tp -55.67 -55.58 30.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.283 -0.872 . . . . 74.120000000000005 111.802 -175.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 68.7 mt -69.21 -32.06 71.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.243 -0.435 . . . . 71.129999999999995 111.745 -176.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 82.5 m -72.35 -44.84 62.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.599 0.238 . . . . 70.109999999999999 111.218 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -69.73 -25.65 63.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.032 0.444 . . . . 64.420000000000002 110.542 -178.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.66 -10.48 59.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.965 -0.562 . . . . 75.209999999999994 110.941 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 72.94 30.35 63.54 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.222 -0.513 . . . . 55.229999999999997 112.73 178.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.4 mt -118.29 17.74 13.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.055 0.455 . . . . 75.209999999999994 111.057 -178.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.622 ' HA ' HD11 ' A' ' 93' ' ' LEU . . . -77.83 85.43 4.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.252 -0.431 . . . . 60.439999999999998 110.29 178.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -141.18 -40.37 0.39 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.826 -0.624 . . . . 75.409999999999997 110.657 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -88.34 -1.28 57.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.463 -0.335 . . . . 73.319999999999993 111.349 -177.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.622 HD11 ' HA ' ' A' ' 90' ' ' ALA . 7.1 mp -65.97 118.42 9.74 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.998 -0.371 . . . . 72.420000000000002 109.998 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.54 18.28 15.11 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.718 -0.393 . . . . 73.239999999999995 111.597 -172.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 19.5 m -73.27 -22.81 60.3 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.327 -0.249 . . . . 64.219999999999999 110.327 176.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 25.6 t70 75.53 -44.44 0.52 Allowed 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.889 0.876 . . . . 73.209999999999994 111.718 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 C--O 1.252 1.184 0 CA-C-O 118.575 -0.726 . . . . 74.540000000000006 109.859 176.346 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.5 ttp . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.002 -0.37 . . . . 72.140000000000001 110.002 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -172.46 45.38 0.17 Allowed Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.611 -0.596 . . . . 71.019999999999996 111.611 -179.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.6 p -88.07 83.4 7.01 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.214 0.531 . . . . 74.120000000000005 111.064 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t -124.2 113.84 18.84 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.108 -0.701 . . . . 62.200000000000003 109.108 179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -104.6 117.25 33.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.507 -0.315 . . . . 73.129999999999995 110.267 -175.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -145.63 105.67 4.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.179 -0.464 . . . . 75.340000000000003 109.862 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -168.23 32.92 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.306 0.575 . . . . 71.519999999999996 109.664 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 -80.66 129.51 34.56 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.774 -0.648 . . . . 74.150000000000006 110.886 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -141.1 107.73 5.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.274 -0.421 . . . . 61.149999999999999 110.754 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.458 ' HA ' ' OD2' ' A' ' 46' ' ' ASP . 55.8 t-80 -60.98 107.67 0.75 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.932 -0.576 . . . . 75.319999999999993 110.799 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.4 m -116.9 -1.01 12.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.122 0.487 . . . . 72.0 111.067 -178.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.6 p -87.52 88.99 7.83 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.243 0.544 . . . . 63.149999999999999 110.779 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -122.42 63.9 0.52 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.651 -0.785 . . . . 33.130000000000003 112.844 -177.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -163.03 111.18 1.26 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.982 0.42 . . . . 74.530000000000001 111.742 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.19 102.86 8.19 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.416 -0.957 . . . . 72.140000000000001 108.416 169.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.413 ' HB3' HD13 ' A' ' 17' ' ' LEU . 5.2 t-20 -116.2 -21.77 9.21 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.205 -0.452 . . . . 75.420000000000002 111.881 -167.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.413 HD13 ' HB3' ' A' ' 16' ' ' ASN . 5.3 mp -111.46 -158.61 0.65 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.74 -0.467 . . . . 53.409999999999997 109.74 -175.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -162.2 128.36 3.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.247 -0.433 . . . . 74.329999999999998 110.052 173.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.462 ' HD2' ' HB3' ' A' ' 74' ' ' GLU . 85.5 t80 -130.76 134.48 46.92 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.122 -0.49 . . . . 63.43 109.847 177.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -78.55 111.63 14.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.502 0.668 . . . . 62.439999999999998 110.782 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 152.98 -156.68 26.86 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 110.49 -1.044 . . . . 51.119999999999997 110.49 -178.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.441 ' HB3' HD13 ' A' ' 23' ' ' LEU . 35.3 m80 -138.42 -88.09 0.24 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.322 0.561 . . . . 73.549999999999997 110.774 175.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 22' ' ' HIS . 6.6 mp -114.78 140.93 48.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.816 0.341 . . . . 72.439999999999998 110.893 -178.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -127.41 155.77 43.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.837 -0.62 . . . . 70.25 110.957 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.839 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 42.7 tt0 -74.92 117.4 16.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.98 -0.555 . . . . 64.530000000000001 110.378 -179.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.481 HD21 ' HA ' ' A' ' 26' ' ' LEU . 10.0 mt -86.1 -45.34 11.48 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.069 -0.514 . . . . 75.0 111.566 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.1 tp -140.04 139.77 36.03 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.084 -0.507 . . . . 73.219999999999999 111.262 -165.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -115.49 94.94 4.92 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.331 -0.85 . . . . 73.239999999999995 108.712 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.404 ' O ' ' HB3' ' A' ' 68' ' ' ARG . 43.0 m -137.74 104.74 5.39 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.247 0.546 . . . . 74.340000000000003 112.403 -169.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -89.74 -1.05 57.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.246 0.546 . . . . 73.299999999999997 109.727 174.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -68.88 -33.98 74.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.142 -0.936 . . . . 75.209999999999994 111.682 -176.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 73.23 -50.85 0.7 Allowed 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.663 0.785 . . . . 75.219999999999999 112.096 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 56.3 t -66.64 -49.15 77.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.689 0.28 . . . . 62.020000000000003 110.521 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.5 tp -56.93 -38.29 72.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.197 0.522 . . . . 75.099999999999994 110.287 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.0 tt -63.69 -32.75 74.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 74.540000000000006 110.562 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.7 m -61.83 -37.04 82.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.995 0.426 . . . . 70.109999999999999 110.888 -179.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.3 -42.99 74.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 73.230000000000004 110.649 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 85.1 t -67.14 -42.49 88.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.008 -0.542 . . . . 74.420000000000002 110.612 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.96 -35.03 89.96 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.773 -0.649 . . . . 44.310000000000002 112.486 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -32.89 74.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.708 0.289 . . . . 63.109999999999999 110.796 178.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.3 mt -69.31 -49.5 55.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.462 . . . . 71.209999999999994 110.477 178.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.545 ' HA ' HD13 ' A' ' 47' ' ' ILE . 76.2 mt -62.75 -55.16 29.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.703 -0.68 . . . . 72.019999999999996 111.077 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.37 -25.07 67.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 72.439999999999998 111.214 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.53 -30.65 75.11 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 121.062 -0.589 . . . . 74.219999999999999 112.431 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -109.76 8.16 24.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.963 0.411 . . . . 54.420000000000002 110.63 178.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.458 ' OD2' ' HA ' ' A' ' 10' ' ' HIS . 26.2 t0 56.52 43.24 26.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 122.021 0.915 . . . . 64.030000000000001 110.623 -175.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.545 HD13 ' HA ' ' A' ' 42' ' ' LEU . 68.0 mt -67.66 -27.46 38.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 114.949 -1.023 . . . . 71.329999999999998 109.816 174.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.56 -178.79 35.52 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.163 -0.926 . . . . 73.439999999999998 111.468 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -165.81 125.31 1.69 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.018 0.437 . . . . 75.510000000000005 111.618 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.658 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 61.7 tp -105.88 100.14 9.7 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 107.988 -1.115 . . . . 73.329999999999998 107.988 166.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 21.9 m -116.55 172.64 4.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.473 -0.331 . . . . 50.340000000000003 111.755 -172.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.411 HD11 ' HA ' ' A' ' 52' ' ' LEU . 4.2 mm? 68.08 -169.73 0.19 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.414 -0.812 . . . . 70.530000000000001 111.648 178.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -158.91 -38.65 0.06 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.349 -0.841 . . . . 73.200000000000003 109.052 -176.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 23.1 tm0? -147.04 135.6 21.95 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.075 -1.083 . . . . 53.240000000000002 108.075 172.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -103.07 122.86 45.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.11 0.481 . . . . 72.319999999999993 111.671 -173.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.8 ptt? -152.69 -171.71 4.02 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.8 -0.636 . . . . 75.219999999999999 109.358 177.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.9 m -63.24 138.32 58.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.871 0.367 . . . . 72.510000000000005 110.631 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.6 tt -78.15 128.75 38.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.148 0.499 . . . . 75.349999999999994 111.229 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -141.94 125.14 16.4 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.506 -0.924 . . . . 70.510000000000005 108.506 177.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -127.63 178.97 5.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.875 0.369 . . . . 71.040000000000006 110.984 -176.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 138.73 -115.89 1.2 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.433 -0.667 . . . . 60.140000000000001 111.433 -177.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.3 m -118.69 82.0 1.78 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.94 0.4 . . . . 74.099999999999994 110.262 177.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 25.9 tp -175.78 97.44 0.07 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.885 -0.598 . . . . 75.200000000000003 109.844 -177.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -105.72 64.33 0.3 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.634 -0.793 . . . . 64.030000000000001 111.998 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 64.8 t -90.16 -32.18 5.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 120.878 0.371 . . . . 54.420000000000002 110.681 -178.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.414 ' N ' HD13 ' A' ' 66' ' ' ILE . 3.8 mp -98.89 107.9 46.06 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.124 -0.489 . . . . 64.310000000000002 110.333 -179.094 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -82.5 104.96 1.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 122.3 2.0 . . . . 65.430000000000007 111.41 176.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.404 ' HB3' ' O ' ' A' ' 29' ' ' THR . 24.0 ttm180 -72.97 117.85 15.2 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.268 -0.642 . . . . 73.109999999999999 109.268 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.428 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 8.9 ptp85 -113.84 134.48 54.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.783 -0.644 . . . . 72.140000000000001 111.236 -172.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 24.4 t -101.71 127.43 55.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.896 -0.593 . . . . 72.400000000000006 110.526 174.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.839 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.9 mp -121.66 147.68 45.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.794 -0.185 . . . . 63.329999999999998 111.115 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.491 HG23 HD21 ' A' ' 77' ' ' LEU . 35.7 m -134.67 178.76 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 109.441 -0.577 . . . . 75.510000000000005 109.441 173.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.413 ' HA ' ' O ' ' A' ' 22' ' ' HIS . 7.4 p80 -96.65 177.14 5.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.73 0.3 . . . . 63.310000000000002 111.635 -174.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.462 ' HB3' ' HD2' ' A' ' 19' ' ' PHE . 0.0 OUTLIER -67.24 169.43 8.73 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.142 -0.481 . . . . 64.030000000000001 111.855 -178.857 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.1 t70 66.77 -65.39 0.21 Allowed 'General case' 0 N--CA 1.471 0.587 0 O-C-N 124.03 0.831 . . . . 64.319999999999993 109.877 -174.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -54.32 -26.56 30.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.677 -1.147 . . . . 70.420000000000002 111.164 176.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.491 HD21 HG23 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -50.03 -40.66 45.55 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.798 -0.637 . . . . 62.240000000000002 110.554 178.357 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.52 -41.46 69.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 63.5 110.872 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.23 -45.33 81.59 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.085 -0.579 . . . . 74.349999999999994 112.145 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.34 93.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.653 0.263 . . . . 75.150000000000006 110.855 178.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 30.1 mtp180 -60.2 -48.71 80.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.448 -0.342 . . . . 75.340000000000003 110.717 177.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -59.34 -40.52 86.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.062 -0.517 . . . . 73.319999999999993 110.688 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 42.0 tp -61.79 -49.45 76.31 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.888 -0.596 . . . . 73.299999999999997 110.809 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.6 mp -68.28 -29.03 67.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.088 -0.505 . . . . 51.039999999999999 111.4 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 51.1 m -69.56 -45.27 69.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.764 0.316 . . . . 63.200000000000003 110.251 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -62.4 -36.93 83.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 74.129999999999995 110.832 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.26 -18.09 60.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.92 -0.582 . . . . 74.099999999999994 111.153 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 83.02 23.37 55.53 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.123 -0.56 . . . . 55.140000000000001 113.02 177.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.1 mt -107.01 -3.03 20.51 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 122.541 -0.388 . . . . 51.32 111.186 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.764 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -75.56 86.23 2.65 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.352 -0.385 . . . . 61.240000000000002 111.152 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -147.16 -43.26 0.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.113 -0.494 . . . . 64.409999999999997 110.757 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -91.75 18.53 7.51 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.35 0.595 . . . . 60.299999999999997 110.69 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.764 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.7 mp -82.18 167.02 19.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.66 -0.7 . . . . 73.439999999999998 111.525 -177.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.58 ' HD2' ' OE1' ' A' ' 25' ' ' GLU . 28.0 ttt180 -103.06 94.49 5.57 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.471 -0.786 . . . . 71.319999999999993 109.4 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 96' ' ' ASP . 38.2 m -127.69 86.9 2.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 111.922 0.342 . . . . 63.009999999999998 111.922 -175.148 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 95' ' ' SER . 30.1 t70 165.95 -40.5 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 O-C-N 124.328 1.018 . . . . 72.400000000000006 109.7 172.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.257 -0.878 . . . . 70.049999999999997 110.44 -178.735 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mpp? . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 110.085 -0.339 . . . . 72.109999999999999 110.085 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -174.17 70.15 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.998 -0.62 . . . . 71.019999999999996 111.839 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 m -106.94 26.18 10.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.976 0.417 . . . . 53.399999999999999 110.395 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.2 m -92.1 112.33 24.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.462 0.649 . . . . 74.120000000000005 111.525 -175.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.1 m170 -118.84 113.21 20.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.598 -0.728 . . . . 73.430000000000007 109.724 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -110.52 115.3 29.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.06 0.457 . . . . 74.019999999999996 109.903 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.4 p80 -151.76 134.74 15.74 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.973 -0.558 . . . . 73.349999999999994 110.429 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -150.97 123.66 8.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.833 -0.621 . . . . 74.010000000000005 110.086 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.76 88.54 1.41 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.355 -0.384 . . . . 75.329999999999998 110.551 -175.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -164.25 134.11 4.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.277 -0.638 . . . . 72.219999999999999 109.277 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.2 m -157.61 110.74 2.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.639 0.257 . . . . 63.539999999999999 111.282 -178.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 p -166.23 143.72 5.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 62.049999999999997 110.441 174.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 150.04 108.4 0.44 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.89 -0.672 . . . . 74.25 112.114 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 -173.41 -60.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.985 0.421 . . . . 72.099999999999994 110.383 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -70.9 130.91 42.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.438 -0.801 . . . . 72.120000000000005 111.816 -172.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -126.31 149.12 49.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.423 -0.808 . . . . 73.299999999999997 109.312 175.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 75.8 mt -147.13 116.41 6.97 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.603 -0.271 . . . . 70.109999999999999 111.485 -175.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -157.75 137.3 12.04 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.274 -0.421 . . . . 74.340000000000003 110.193 173.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.78 ' HB2' ' HA ' ' A' ' 75' ' ' ASP . 96.6 m-85 -129.09 128.87 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.695 -0.684 . . . . 75.239999999999995 109.876 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -89.8 131.27 35.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.128 0.49 . . . . 51.32 111.069 -176.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 164.82 -164.49 37.0 Favored Glycine 0 N--CA 1.443 -0.867 0 N-CA-C 111.236 -0.746 . . . . 61.020000000000003 111.236 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.41 ' HB3' ' H ' ' A' ' 23' ' ' LEU . 6.3 t-80 -134.63 -100.79 0.24 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.84 -0.43 . . . . 71.549999999999997 109.84 177.456 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.523 HD22 HD13 ' A' ' 50' ' ' LEU . 5.7 mp -143.33 120.56 11.52 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.149 -0.315 . . . . 74.329999999999998 110.149 176.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.414 ' HB3' ' OD1' ' A' ' 96' ' ' ASP . 50.6 mtm180 -111.34 170.32 8.2 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.996 -0.372 . . . . 74.439999999999998 109.996 173.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.659 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 36.6 tt0 -81.82 135.06 35.47 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.79 0.329 . . . . 72.049999999999997 111.29 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.807 HD21 HG21 ' A' ' 72' ' ' VAL . 4.4 mm? -97.23 -67.19 0.86 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.056 -0.52 . . . . 71.340000000000003 110.034 175.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.606 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -142.82 157.9 44.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.24 -0.437 . . . . 72.430000000000007 110.559 177.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -138.01 101.73 4.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.828 -0.804 . . . . 63.509999999999998 108.828 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.0 t -113.59 170.25 8.38 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.242 -0.436 . . . . 74.310000000000002 110.525 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.462 HD21 ' HG2' ' A' ' 67' ' ' PRO . 11.1 m120 -104.57 -3.78 23.42 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.066 0.46 . . . . 74.530000000000001 109.768 177.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -105.98 156.71 18.1 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.734 -0.666 . . . . 73.430000000000007 111.174 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.73 -15.13 11.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.199 -0.455 . . . . 73.109999999999999 110.999 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 82.5 t -71.75 -49.51 45.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.007 0.432 . . . . 74.040000000000006 110.744 -177.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.4 tp -59.86 -31.78 70.09 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.886 -0.597 . . . . 72.109999999999999 110.684 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 76.3 mt -67.58 -22.98 65.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.506 . . . . 73.200000000000003 111.54 -178.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.6 m -67.97 -36.9 80.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.007 0.432 . . . . 73.129999999999995 110.238 176.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -72.18 -45.35 60.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 74.109999999999999 110.317 177.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.7 t -63.81 -42.77 96.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.76 -0.654 . . . . 61.549999999999997 110.972 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.35 -37.42 94.03 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.816 -0.629 . . . . 62.229999999999997 112.239 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.42 -31.3 72.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.758 0.314 . . . . 75.25 111.006 178.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 91.0 mt -70.42 -51.02 32.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.959 0.409 . . . . 74.430000000000007 110.159 177.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.649 ' HA ' HD11 ' A' ' 47' ' ' ILE . 48.3 mt -58.67 -52.87 63.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.602 -0.726 . . . . 72.319999999999993 110.969 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -67.75 -34.35 76.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.601 -0.727 . . . . 72.030000000000001 111.168 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.62 -15.2 61.51 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 116.12 -0.491 . . . . 63.25 112.443 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -100.76 -65.58 0.96 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.563 0.221 . . . . 64.329999999999998 110.609 176.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.0 t70 164.37 -19.78 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.402 -0.817 . . . . 73.329999999999998 109.09 -173.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.649 HD11 ' HA ' ' A' ' 42' ' ' LEU . 23.9 mt -51.04 106.41 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 114.179 -1.373 . . . . 74.219999999999999 112.869 -166.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.59 114.16 6.44 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.414 -0.812 . . . . 41.0 111.274 173.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -127.34 130.45 49.47 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.931 0.396 . . . . 75.319999999999993 110.647 -173.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.523 HD13 HD22 ' A' ' 23' ' ' LEU . 8.7 mp -106.66 112.16 25.02 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.858 -0.61 . . . . 75.319999999999993 110.05 179.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 m -94.97 104.69 16.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.86 -0.609 . . . . 72.349999999999994 110.512 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.2 tt -102.18 124.86 48.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.847 -0.615 . . . . 73.129999999999995 110.563 -175.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.656 ' HB3' ' HE ' ' A' ' 68' ' ' ARG . 3.6 p30 -129.36 152.34 49.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.927 -0.579 . . . . 72.340000000000003 109.782 173.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.613 ' HB2' ' HB ' ' A' ' 66' ' ' ILE . 60.4 mt-30 -131.83 28.51 4.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.64 0.257 . . . . 72.299999999999997 111.342 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -75.15 102.36 4.91 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.907 -0.775 . . . . 73.319999999999993 108.907 174.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 62.2 mtm -76.34 -74.59 0.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.733 -0.667 . . . . 75.239999999999995 111.943 -170.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.3 m -99.38 128.31 45.49 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.249 -0.432 . . . . 70.0 110.398 -175.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 8.7 tt -117.75 101.06 11.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.711 0.767 . . . . 71.019999999999996 110.834 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.9 tp -92.63 -31.98 14.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.526 -0.761 . . . . 71.439999999999998 109.291 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -158.36 -44.89 0.06 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.796 -1.093 . . . . 74.040000000000006 108.303 177.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.56 -53.8 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.525 -0.761 . . . . 62.43 111.733 177.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 67.7 m 70.77 167.14 0.3 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.288 0.635 . . . . 72.349999999999994 112.084 178.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -90.89 92.3 8.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.931 -0.577 . . . . 52.020000000000003 110.132 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.5 98.76 1.05 Allowed Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.684 -0.769 . . . . 61.420000000000002 111.754 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 31.9 t -57.19 -45.64 84.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.457 0.646 . . . . 75.129999999999995 109.846 177.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.613 ' HB ' ' HB2' ' A' ' 54' ' ' GLN . 4.2 mp -113.56 91.66 21.3 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.273 -0.876 . . . . 74.430000000000007 108.67 171.134 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.462 ' HG2' HD21 ' A' ' 30' ' ' ASN . 21.9 Cg_exo -65.89 -69.39 0.03 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.797 2.332 . . . . 71.319999999999993 111.76 -178.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.656 ' HE ' ' HB3' ' A' ' 53' ' ' ASP . 0.7 OUTLIER -158.08 116.63 3.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.11 -0.495 . . . . 75.340000000000003 110.367 175.778 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -113.91 132.41 55.94 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.739 -0.664 . . . . 75.109999999999999 109.33 177.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 52.2 t -109.74 118.49 56.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.405 -0.361 . . . . 73.120000000000005 110.448 -177.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.659 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.5 mp -125.74 144.37 50.65 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.996 -0.547 . . . . 62.200000000000003 109.914 177.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.807 HG21 HD21 ' A' ' 26' ' ' LEU . 33.2 m -127.68 165.66 26.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.931 -0.396 . . . . 75.340000000000003 109.931 177.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.48 ' ND1' ' HB3' ' A' ' 75' ' ' ASP . 0.4 OUTLIER -69.59 133.82 48.06 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.582 -0.281 . . . . 71.109999999999999 110.504 178.307 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.467 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 43.7 mm-40 -51.5 -28.46 13.55 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.137 0.575 . . . . 72.549999999999997 111.945 -177.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.78 ' HA ' ' HB2' ' A' ' 19' ' ' PHE . 34.9 t70 -58.4 -17.7 22.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.453 -0.794 . . . . 71.0 112.124 -179.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -131.59 13.24 4.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.157 0.503 . . . . 74.099999999999994 109.928 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.467 ' HB2' ' HA ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -57.3 -51.21 70.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.983 -0.553 . . . . 73.099999999999994 110.883 -174.441 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.16 -36.2 82.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.904 -0.589 . . . . 75.420000000000002 111.459 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.61 -47.39 21.32 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.627 -0.797 . . . . 71.230000000000004 111.956 -179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.05 -44.67 87.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.691 0.256 . . . . 71.400000000000006 111.691 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -59.68 -49.13 78.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.695 -0.229 . . . . 63.229999999999997 111.575 -177.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -65.56 -35.28 80.39 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.424 -0.51 . . . . 72.400000000000006 110.712 -178.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.2 tp -61.97 -43.07 99.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.932 0.396 . . . . 75.329999999999998 110.211 178.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.73 -28.54 66.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.0 -0.546 . . . . 74.310000000000002 111.236 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.458 ' HA ' ' HB1' ' A' ' 90' ' ' ALA . 19.2 m -77.33 -48.81 16.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.164 0.507 . . . . 64.010000000000005 110.781 176.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.04 -44.39 76.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.167 -0.924 . . . . 65.019999999999996 112.122 -171.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -123.06 28.3 7.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.89 0.376 . . . . 71.230000000000004 111.747 -175.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -139.96 -80.98 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.103 -1.046 . . . . 73.540000000000006 112.252 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.531 HD13 ' OE1' ' A' ' 92' ' ' GLU . 0.6 OUTLIER -179.12 -57.12 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 122.321 0.248 . . . . 63.009999999999998 111.187 -173.434 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.961 ' HA ' HD11 ' A' ' 93' ' ' LEU . . . 60.12 20.99 10.24 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.025 0.53 . . . . 74.439999999999998 112.055 -177.048 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . 0.446 ' H ' HD11 ' A' ' 89' ' ' LEU . 57.1 t-80 -100.67 -29.27 12.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.089 0.471 . . . . 73.129999999999995 110.651 -176.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.531 ' OE1' HD13 ' A' ' 89' ' ' LEU . 5.4 mp0 -94.75 6.96 47.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.823 -0.626 . . . . 75.450000000000003 110.701 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.961 HD11 ' HA ' ' A' ' 90' ' ' ALA . 11.1 mp -73.13 150.61 42.08 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.205 -0.452 . . . . 74.150000000000006 110.701 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 94' ' ' ARG . 22.3 ttt85 -121.93 -64.15 1.24 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.533 -0.758 . . . . 75.120000000000005 109.755 -173.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.54 ' HA ' ' O ' ' A' ' 25' ' ' GLU . 16.3 m 69.67 165.39 0.27 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.454 -0.793 . . . . 74.319999999999993 111.655 177.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . 0.414 ' OD1' ' HB3' ' A' ' 24' ' ' ARG . 11.0 p-10 -111.24 -9.93 14.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.05 -0.523 . . . . 72.25 110.704 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.582 -0.723 . . . . 53.240000000000002 110.395 173.752 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 mmt . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.748 0.308 . . . . 52.439999999999998 110.201 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 106.98 56.9 0.61 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.929 -0.653 . . . . 63.329999999999998 112.299 177.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.7 m -116.82 78.54 1.22 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.037 0.446 . . . . 71.25 110.697 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.2 m -127.03 144.52 51.0 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.08 -0.509 . . . . 73.010000000000005 110.435 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -134.71 101.58 4.98 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.182 -0.673 . . . . 73.030000000000001 109.182 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.7 t60 -135.58 125.94 26.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.856 -0.611 . . . . 75.439999999999998 111.165 -172.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -150.3 132.98 15.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.157 -0.474 . . . . 71.519999999999996 109.903 173.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 t60 -132.8 108.95 9.31 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.724 -0.473 . . . . 73.010000000000005 109.724 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -152.04 98.5 2.44 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.302 -0.408 . . . . 74.439999999999998 111.107 -175.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -157.14 113.0 2.9 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.354 0.597 . . . . 55.530000000000001 110.344 173.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.7 m -134.5 137.23 43.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.6 -0.727 . . . . 75.129999999999995 109.661 178.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.3 m -139.55 167.04 22.99 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.038 -0.528 . . . . 73.209999999999994 110.122 -176.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 141.51 85.52 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.131 -1.033 . . . . 75.109999999999999 113.728 174.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 17.1 ptt180 -149.82 100.88 3.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.233 0.539 . . . . 73.439999999999998 110.692 172.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -166.05 144.93 5.92 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.019 -0.537 . . . . 73.140000000000001 110.275 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -179.58 19.11 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.536 0.523 . . . . 70.430000000000007 110.763 177.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 93.6 mt -101.64 156.29 17.58 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.08 0.4 . . . . 74.219999999999999 112.08 -171.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.409 ' O ' ' HB2' ' A' ' 19' ' ' PHE . 0.2 OUTLIER 72.36 -177.57 0.19 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.074 -0.966 . . . . 74.040000000000006 112.564 171.836 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.409 ' HB2' ' O ' ' A' ' 18' ' ' TYR . 87.8 m-85 78.88 63.0 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.204 1.002 . . . . 73.099999999999994 111.912 175.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -141.18 147.1 37.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.823 -0.626 . . . . 71.340000000000003 109.91 172.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 166.76 -138.84 5.41 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.472 -0.87 . . . . 74.120000000000005 112.758 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.7 m-70 -123.05 75.41 1.29 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.66 -0.496 . . . . 72.140000000000001 109.66 178.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 93.2 mt 63.17 162.88 0.1 Allowed 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.806 0.691 . . . . 74.319999999999993 110.509 -171.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.76 HH12 ' HB3' ' A' ' 97' ' ' ASP . 27.8 mmm180 -132.74 127.52 34.88 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.992 -0.442 . . . . 71.329999999999998 110.889 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.523 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 42.5 tt0 -70.56 120.93 16.92 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.557 -0.747 . . . . 74.340000000000003 109.05 174.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.46 HD13 HD23 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -79.6 -51.96 8.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.889 0.376 . . . . 74.530000000000001 110.098 -174.895 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.46 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 pt? -157.4 154.53 29.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.177 -0.465 . . . . 74.430000000000007 110.701 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.567 ' HG3' ' HB3' ' A' ' 69' ' ' ARG . 22.1 ttm180 -131.7 111.41 11.65 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.702 -0.851 . . . . 74.239999999999995 108.702 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.7 t -126.92 164.7 20.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.138 0.494 . . . . 72.340000000000003 111.523 -173.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.433 ' ND2' ' HB3' ' A' ' 67' ' ' PRO . 8.1 m120 -107.88 -6.89 16.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.655 -0.702 . . . . 74.439999999999998 109.955 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -95.45 134.47 38.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.763 -0.653 . . . . 75.040000000000006 111.332 -175.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.35 -33.26 49.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.813 -0.63 . . . . 73.400000000000006 111.587 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.1 t -59.96 -47.44 91.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 120.93 0.395 . . . . 63.049999999999997 110.69 -177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.3 tp -62.22 -40.24 95.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.672 -0.695 . . . . 75.340000000000003 110.572 178.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.63 -43.41 98.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 72.049999999999997 111.081 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.6 m -59.5 -40.78 88.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.791 0.329 . . . . 64.109999999999999 111.016 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -71.97 -54.64 9.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.117 -0.492 . . . . 65.349999999999994 111.181 -177.528 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.43 HG11 HD22 ' A' ' 84' ' ' LEU . 86.9 t -61.26 -39.53 82.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.194 0.521 . . . . 73.450000000000003 110.315 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.82 -49.0 80.33 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.351 -0.841 . . . . 71.310000000000002 112.262 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.28 -33.02 74.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.639 0.257 . . . . 74.319999999999993 111.305 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 95.0 mt -65.68 -51.78 56.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.323 -0.399 . . . . 63.420000000000002 110.678 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.6 mt -74.39 -27.3 60.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.113 -0.494 . . . . 72.129999999999995 110.671 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -74.91 -55.63 5.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.13 -0.486 . . . . 74.099999999999994 110.631 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.66 -36.2 92.06 Favored Glycine 0 C--N 1.332 0.31 0 CA-C-N 115.698 -0.683 . . . . 70.310000000000002 112.84 -175.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.47 ' HB1' HG12 ' A' ' 47' ' ' ILE . . . -82.81 -1.69 52.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.763 0.316 . . . . 72.219999999999999 110.747 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.2 t70 60.72 26.78 16.55 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.462 0.648 . . . . 74.319999999999993 111.067 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.47 HG12 ' HB1' ' A' ' 45' ' ' ALA . 47.2 mm -63.64 -39.32 84.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.532 0.682 . . . . 75.349999999999994 110.106 -179.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 110.64 125.79 4.9 Favored Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.208 -0.905 . . . . 61.539999999999999 112.276 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -139.0 141.81 38.32 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.71 0.291 . . . . 73.25 110.683 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.6 90.67 3.37 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.313 -0.995 . . . . 74.530000000000001 108.313 171.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.9 m -130.85 -174.63 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.974 -0.557 . . . . 72.409999999999997 111.499 -175.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 36.0 tp -160.49 156.62 26.21 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.398 -0.964 . . . . 74.530000000000001 108.398 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -70.14 145.39 51.56 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.429 -0.582 . . . . 65.420000000000002 109.429 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.436 ' O ' ' HB ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -122.27 18.07 10.67 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.915 0.709 . . . . 74.420000000000002 112.915 -168.824 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -146.72 138.39 24.49 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.268 -0.573 . . . . 63.299999999999997 110.647 177.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.42 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 3.5 mpp? -79.4 143.65 34.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.286 -0.416 . . . . 72.25 110.443 -178.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.6 m -83.96 63.94 7.86 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.726 -0.472 . . . . 71.439999999999998 109.726 177.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.3 mm 69.23 90.61 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 CA-C-N 115.298 -0.865 . . . . 72.019999999999996 110.373 -174.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.552 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 64.6 tp -160.37 104.75 1.45 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.605 -0.725 . . . . 75.340000000000003 109.681 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.552 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 11.7 pt-20 55.57 -54.6 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.736 1.614 . . . . 71.519999999999996 113.326 -175.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -106.79 114.08 4.26 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.979 -0.849 . . . . 42.100000000000001 110.979 175.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.2 m -63.24 -44.69 94.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.993 0.425 . . . . 53.109999999999999 110.845 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 44.0 tp -123.73 88.27 2.88 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.216 -0.447 . . . . 74.540000000000006 109.847 175.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.65 147.83 18.97 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 121.003 -0.618 . . . . 64.209999999999994 111.995 -179.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.1 t -106.85 91.77 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.107 0.479 . . . . 73.319999999999993 110.253 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.436 ' HB ' ' O ' ' A' ' 54' ' ' GLN . 50.1 mm -101.22 108.74 56.25 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.972 -0.558 . . . . 75.329999999999998 109.708 175.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.433 ' HB3' ' ND2' ' A' ' 30' ' ' ASN . 37.3 Cg_endo -67.25 111.6 2.31 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 122.633 2.222 . . . . 61.229999999999997 111.708 179.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.474 ' HA ' ' HD2' ' A' ' 68' ' ' ARG . 10.1 tpt180 -100.87 140.81 34.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.38 0.61 . . . . 75.329999999999998 110.985 -177.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.567 ' HB3' ' HG3' ' A' ' 28' ' ' ARG . 28.3 ptt180 -113.61 146.69 39.35 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.135 -0.939 . . . . 74.109999999999999 110.357 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 64.6 t -110.04 116.75 53.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.415 -0.357 . . . . 73.349999999999994 110.444 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.523 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.7 mp -102.79 137.62 40.76 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.548 -0.538 . . . . 71.239999999999995 109.548 174.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 25.3 m -114.99 176.9 2.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.227 -0.442 . . . . 65.340000000000003 110.504 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -69.9 129.33 39.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.686 -0.688 . . . . 75.319999999999993 109.519 176.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -57.75 -35.93 71.39 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.006 0.431 . . . . 64.049999999999997 111.125 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.6 -16.91 61.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.731 -0.668 . . . . 63.409999999999997 110.142 -176.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -111.33 23.62 13.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.964 -0.562 . . . . 71.540000000000006 110.093 -175.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.516 HD23 ' HB2' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -51.32 -50.86 58.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.753 -0.658 . . . . 71.099999999999994 110.711 -178.436 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.13 -28.37 66.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.019 -0.537 . . . . 72.319999999999993 111.622 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.42 -57.23 5.18 Favored Glycine 0 C--O 1.236 0.23 0 C-N-CA 120.718 -0.754 . . . . 71.409999999999997 112.611 -175.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.38 -42.87 96.75 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.889 0.329 . . . . 73.120000000000005 111.889 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.507 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 14.6 ptm180 -67.22 -33.23 74.91 Favored 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 120.943 -0.303 . . . . 72.329999999999998 110.91 -178.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -63.0 -42.28 99.81 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.016 0.436 . . . . 73.530000000000001 109.852 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 34.8 tp -58.49 -46.99 85.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.6 -0.727 . . . . 70.5 110.451 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.43 HD22 HG11 ' A' ' 38' ' ' VAL . 84.0 mt -68.49 -32.46 72.47 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.768 -0.651 . . . . 64.310000000000002 111.226 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.6 m -70.37 -36.82 74.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.975 0.417 . . . . 64.129999999999995 110.551 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -69.04 -40.58 78.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.019 -0.537 . . . . 64.019999999999996 110.445 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.48 -30.16 69.78 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.868 -0.605 . . . . 73.200000000000003 111.044 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 100.29 -13.79 59.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.121 -0.562 . . . . 73.319999999999993 112.673 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 61.6 mt -78.91 1.9 21.99 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.178 0.436 . . . . 63.530000000000001 112.178 -176.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -75.73 91.32 2.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.056 0.455 . . . . 62.119999999999997 109.827 175.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -140.46 -40.32 0.42 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.904 -0.589 . . . . 75.129999999999995 110.001 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.6 mp0 -87.39 29.63 0.85 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.627 -0.715 . . . . 74.109999999999999 111.492 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.471 HD12 ' H ' ' A' ' 93' ' ' LEU . 4.1 mp -62.81 145.1 55.76 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.705 0.288 . . . . 72.510000000000005 110.482 -178.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.419 ' HD2' ' HA ' ' A' ' 94' ' ' ARG . 2.3 tpt180 -129.43 173.19 10.78 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.728 -0.471 . . . . 71.450000000000003 109.728 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 58.2 m -149.01 121.43 8.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.861 0.362 . . . . 71.25 110.198 177.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -103.16 90.2 3.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.178 0.513 . . . . 74.450000000000003 111.316 -176.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.76 ' HB3' HH12 ' A' ' 24' ' ' ARG . 5.9 p-10 . . . . . 0 C--O 1.248 0.991 0 CA-C-N 115.537 -0.756 . . . . 75.430000000000007 109.962 177.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.484 1.255 0 CA-C-O 120.529 0.204 . . . . 72.25 110.986 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.18 127.59 0.92 Allowed Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 120.222 -0.99 . . . . 54.119999999999997 113.065 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.2 p -153.4 82.24 1.18 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.224 -0.658 . . . . 64.439999999999998 109.224 173.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.3 p -89.51 117.76 28.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.78 -0.645 . . . . 74.140000000000001 111.471 -172.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -139.37 111.44 7.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.087 -0.708 . . . . 73.430000000000007 109.087 176.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.6 p-80 -153.38 107.26 3.04 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.081 0.467 . . . . 70.140000000000001 111.18 -177.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -150.7 102.34 3.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.893 -0.594 . . . . 73.030000000000001 111.138 175.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -140.79 118.86 11.92 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.351 -0.611 . . . . 74.209999999999994 109.351 171.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -146.13 95.22 2.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.224 -0.444 . . . . 72.400000000000006 110.639 -177.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -131.76 53.23 2.01 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.814 -0.81 . . . . 75.409999999999997 108.814 174.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -72.46 90.87 1.34 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.324 -0.853 . . . . 72.200000000000003 110.813 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.3 p -121.4 -178.13 3.71 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.84 -0.618 . . . . 75.209999999999994 110.32 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 106.76 90.17 2.14 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.779 -0.724 . . . . 64.019999999999996 111.691 -179.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 14' ' ' ARG . 10.4 ttp180 -76.64 -65.17 0.97 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.641 -0.503 . . . . 62.329999999999998 109.641 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -172.11 111.27 0.27 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.302 -0.863 . . . . 72.340000000000003 110.093 -176.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -164.78 121.1 1.49 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.317 -0.994 . . . . 61.439999999999998 108.317 -178.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 93.1 mt -96.79 99.26 10.85 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.414 0.626 . . . . 65.310000000000002 111.144 -175.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.2 p90 -122.21 95.26 4.58 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.454 -0.793 . . . . 74.310000000000002 110.377 175.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -90.73 -88.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.158 -0.682 . . . . 72.450000000000003 109.158 178.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 66.21 -66.7 0.16 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 124.011 0.819 . . . . 73.299999999999997 112.552 172.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 152.64 153.19 6.21 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.801 -0.92 . . . . 42.109999999999999 110.801 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -108.65 -31.72 7.64 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.557 -0.534 . . . . 73.420000000000002 109.557 178.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.766 HD21 ' HB2' ' A' ' 50' ' ' LEU . 7.4 mp 66.86 154.63 0.09 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.23 -0.895 . . . . 64.530000000000001 111.518 178.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.606 ' HB2' HD11 ' A' ' 77' ' ' LEU . 13.1 mmt180 -115.2 133.18 56.27 Favored 'General case' 0 C--N 1.321 -0.668 0 O-C-N 121.831 -0.543 . . . . 65.530000000000001 110.545 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.595 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.5 tt0 -66.93 126.96 30.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.22 -0.9 . . . . 75.329999999999998 110.409 -176.247 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.456 ' CD1' ' HG2' ' A' ' 81' ' ' ARG . 20.2 tp -106.61 -58.21 1.96 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.41 -0.814 . . . . 72.040000000000006 110.772 -175.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.824 ' HB3' HD23 ' A' ' 93' ' ' LEU . 4.6 pp -147.71 167.99 23.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.388 -0.369 . . . . 71.150000000000006 110.1 178.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.522 ' HD2' ' O ' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -148.02 143.91 27.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.88 0.372 . . . . 75.129999999999995 111.527 179.213 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.8 t -174.02 163.17 3.96 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.605 -0.725 . . . . 73.129999999999995 109.995 178.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -100.06 -4.23 30.3 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.958 0.409 . . . . 54.25 109.924 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.8 117.68 17.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.766 -0.652 . . . . 75.439999999999998 110.344 -177.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.471 ' HB1' HH22 ' A' ' 68' ' ' ARG . . . -74.57 -38.44 62.68 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.323 -0.399 . . . . 64.420000000000002 111.263 -176.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.2 t -63.44 -46.44 95.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.088 0.471 . . . . 74.430000000000007 110.459 -177.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 tp -61.39 -39.95 92.56 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.696 -0.684 . . . . 70.450000000000003 110.584 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.541 ' HA ' HG13 ' A' ' 38' ' ' VAL . 80.9 mt -72.11 -24.65 61.52 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.957 -0.565 . . . . 75.239999999999995 111.514 -178.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -75.05 -27.59 60.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.945 0.403 . . . . 71.329999999999998 110.306 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.62 -53.74 7.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 71.409999999999997 110.582 177.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.707 HG21 HD22 ' A' ' 27' ' ' LEU . 7.2 p -64.92 -35.37 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 120.915 0.388 . . . . 65.439999999999998 111.153 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.37 -38.97 95.53 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.004 -0.617 . . . . 64.439999999999998 112.307 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.96 -29.98 70.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.878 0.371 . . . . 74.109999999999999 111.135 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 88.0 mt -69.39 -49.18 57.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.127 -0.488 . . . . 63.210000000000001 109.968 178.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.9 mt -66.15 -35.0 79.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.672 -0.695 . . . . 74.349999999999994 110.589 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.12 -52.43 48.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.769 -0.651 . . . . 73.109999999999999 110.737 176.196 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.53 -26.88 73.57 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.689 -0.687 . . . . 71.230000000000004 113.966 -173.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.02 9.11 37.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.835 0.318 . . . . 74.430000000000007 111.826 -177.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.6 t70 61.17 29.13 18.63 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.753 0.787 . . . . 73.510000000000005 110.732 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.3 mt -84.26 -47.62 17.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.541 0.686 . . . . 65.209999999999994 110.185 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.21 172.74 38.67 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.083 -0.962 . . . . 73.439999999999998 111.601 -176.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -169.24 142.13 2.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.946 0.403 . . . . 73.239999999999995 111.406 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.766 ' HB2' HD21 ' A' ' 23' ' ' LEU . 1.9 tm? -97.19 102.25 13.98 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.355 -0.98 . . . . 74.230000000000004 108.355 172.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.7 m -131.48 161.66 40.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.977 -0.556 . . . . 64.129999999999995 110.468 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 95.9 mt 68.88 170.69 0.29 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.738 -0.665 . . . . 74.230000000000004 111.516 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -170.59 -45.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.785 -0.643 . . . . 74.230000000000004 110.521 -177.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -57.74 -54.98 40.73 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.321 -0.399 . . . . 71.299999999999997 111.375 -178.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 72.02 -40.72 0.48 Allowed 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.877 0.736 . . . . 74.519999999999996 111.91 177.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 78.9 mtp -73.73 168.63 18.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.833 0.349 . . . . 75.030000000000001 110.746 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.2 p -75.32 164.18 26.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.034 -0.53 . . . . 64.439999999999998 110.224 176.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 5.8 tp -73.5 103.89 2.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.507 0.67 . . . . 74.530000000000001 110.426 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -107.01 127.27 53.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.344 -0.843 . . . . 71.510000000000005 109.059 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -60.83 124.2 19.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.445 0.641 . . . . 73.239999999999995 110.767 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 128.15 -32.55 3.39 Favored Glycine 0 N--CA 1.443 -0.868 0 N-CA-C 110.497 -1.041 . . . . 71.019999999999996 110.497 -173.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.3 p -105.04 104.37 14.1 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.173 -0.677 . . . . 75.230000000000004 109.173 171.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.8 mp -86.1 85.11 7.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.432 0.635 . . . . 75.099999999999994 109.975 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -124.61 109.75 1.29 Allowed Glycine 0 N--CA 1.439 -1.116 0 C-N-CA 120.694 -0.765 . . . . 72.129999999999995 112.728 -177.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 38.8 t -86.25 -16.08 9.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.42 -0.956 . . . . 65.230000000000004 108.42 169.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.696 HG21 ' HG3' ' A' ' 68' ' ' ARG . 5.0 mp 57.41 85.53 0.19 Allowed Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 114.029 -1.441 . . . . 73.540000000000006 111.131 -178.067 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.01 90.9 0.44 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.302 2.002 . . . . 73.340000000000003 110.237 172.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.696 ' HG3' HG21 ' A' ' 66' ' ' ILE . 64.5 mtm180 -75.83 126.46 31.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.671 0.748 . . . . 73.140000000000001 112.337 -170.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -113.13 131.43 55.84 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.584 -1.189 . . . . 72.329999999999998 108.023 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 55.5 t -101.45 111.6 31.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-O 120.769 0.319 . . . . 75.439999999999998 110.772 -172.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.626 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 7.7 mp -102.73 142.73 33.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.639 -0.71 . . . . 74.0 109.104 174.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 20.6 m -119.96 174.26 5.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.204 0.526 . . . . 73.329999999999998 111.484 -174.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.55 ' HD1' ' HB2' ' A' ' 76' ' ' ASP . 32.7 t-80 -57.69 121.89 11.48 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.812 -1.086 . . . . 64.049999999999997 110.949 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.556 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 36.9 mt-10 -62.87 154.0 31.47 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.879 -0.6 . . . . 71.219999999999999 109.459 177.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.556 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 8.6 t70 78.92 -16.79 0.64 Allowed 'General case' 0 N--CA 1.473 0.689 0 O-C-N 123.921 0.763 . . . . 71.349999999999994 111.213 -173.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.55 ' HB2' ' HD1' ' A' ' 73' ' ' HIS . 0.4 OUTLIER -104.36 16.87 25.25 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.159 0.504 . . . . 74.510000000000005 110.246 -177.516 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.606 HD11 ' HB2' ' A' ' 24' ' ' ARG . 4.2 mm? -60.94 -49.09 78.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.671 -0.695 . . . . 61.340000000000003 111.295 -177.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.42 -22.46 66.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.912 0.387 . . . . 73.209999999999994 111.192 -178.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -84.61 -56.08 2.57 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.642 -0.79 . . . . 65.219999999999999 112.541 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.422 ' O ' HD11 ' A' ' 84' ' ' LEU . . . -61.17 -44.42 97.34 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.749 0.277 . . . . 73.340000000000003 111.749 -176.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.456 ' HG2' ' CD1' ' A' ' 26' ' ' LEU . 18.3 mtp180 -63.13 -36.96 85.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.937 0.399 . . . . 62.130000000000003 110.243 -178.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -68.34 -44.07 76.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.993 -0.548 . . . . 73.420000000000002 110.582 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.5 tp -56.28 -49.87 73.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 74.25 111.019 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.422 HD11 ' O ' ' A' ' 80' ' ' ALA . 9.1 mp -67.67 -28.23 67.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 75.340000000000003 111.416 -178.395 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.614 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 61.3 m -81.08 -40.02 24.79 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.47 -0.332 . . . . 74.519999999999996 111.211 -178.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -74.22 -42.28 60.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.27 -0.423 . . . . 63.420000000000002 111.217 -177.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.8 83.82 1.09 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.12 0.486 . . . . 62.109999999999999 110.361 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -170.33 -96.1 0.1 Allowed Glycine 0 N--CA 1.441 -1.01 0 C-N-CA 120.323 -0.942 . . . . 44.299999999999997 112.429 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.613 HD13 ' HB ' ' A' ' 38' ' ' VAL . 1.2 pp -175.0 48.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.197 0.522 . . . . 71.150000000000006 111.182 -172.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.614 ' HB3' ' HA ' ' A' ' 85' ' ' THR . . . -68.44 93.79 0.51 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.173 -0.467 . . . . 63.32 111.587 -177.034 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -151.14 -47.91 0.12 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.061 -0.518 . . . . 74.530000000000001 110.187 176.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -76.73 -0.3 23.19 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.64 -0.709 . . . . 75.340000000000003 110.869 -178.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.824 HD23 ' HB3' ' A' ' 27' ' ' LEU . 90.5 mt -66.91 140.47 57.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.004 -0.544 . . . . 73.299999999999997 110.671 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.491 ' HG2' ' O ' ' A' ' 95' ' ' SER . 45.3 ttt180 -104.54 139.91 38.74 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.85 -0.34 . . . . 74.310000000000002 110.193 175.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.491 ' O ' ' HG2' ' A' ' 94' ' ' ARG . 30.2 m -72.02 162.56 29.29 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.623 -0.51 . . . . 62.310000000000002 109.623 173.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -80.16 52.65 1.59 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.18 0.515 . . . . 63.140000000000001 110.584 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 27.8 t70 . . . . . 0 C--O 1.243 0.737 0 CA-C-N 115.734 -0.666 . . . . 53.310000000000002 109.618 -178.371 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 109.775 -0.454 . . . . 63.119999999999997 109.775 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 174.82 -62.2 0.11 Allowed Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.591 -0.814 . . . . 60.310000000000002 112.216 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.4 m -105.38 101.13 10.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.863 0.363 . . . . 61.329999999999998 110.538 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.2 p -121.69 107.63 12.58 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.041 -0.527 . . . . 72.519999999999996 110.4 177.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -113.58 127.07 55.93 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.548 0.689 . . . . 73.329999999999998 111.505 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -157.04 93.75 1.36 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.889 -1.051 . . . . 72.430000000000007 108.699 175.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -148.8 154.68 39.88 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.367 -0.833 . . . . 60.409999999999997 110.33 -173.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.1 p-80 -156.39 143.12 18.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.826 0.346 . . . . 72.420000000000002 110.739 -177.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -139.82 91.19 2.45 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.944 -0.571 . . . . 71.400000000000006 109.487 177.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -142.0 109.05 5.47 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.047 0.451 . . . . 74.030000000000001 110.563 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.7 t -82.13 -175.78 5.82 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.697 -0.683 . . . . 70.319999999999993 109.376 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.8 m -81.15 78.54 7.94 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.055 0.455 . . . . 74.219999999999999 110.391 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -118.46 134.13 10.74 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.881 -0.675 . . . . 71.219999999999999 111.802 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 14' ' ' ARG . 30.6 ttt180 -164.41 125.54 2.17 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.829 0.347 . . . . 73.420000000000002 110.287 -179.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -142.48 73.59 1.41 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.411 -0.589 . . . . 73.230000000000004 109.411 176.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.544 ' HB3' ' HA ' ' A' ' 75' ' ' ASP . 8.9 p30 -154.42 104.66 2.59 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.858 0.837 . . . . 73.099999999999994 110.717 176.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 90.8 mt -94.32 -5.43 46.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.396 -0.82 . . . . 65.420000000000002 109.171 171.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -116.38 108.53 16.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.906 -1.043 . . . . 71.030000000000001 109.818 178.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -90.21 128.66 36.43 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.048 -0.524 . . . . 75.129999999999995 109.873 177.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.527 ' HG2' ' HG2' ' A' ' 24' ' ' ARG . 21.0 tp60 -96.55 -48.61 5.47 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.51 -0.552 . . . . 74.099999999999994 109.51 -179.091 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 148.34 -59.59 0.46 Allowed Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 115.451 -0.795 . . . . 42.219999999999999 111.896 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -145.2 -55.1 0.31 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.8 0.333 . . . . 62.229999999999997 111.379 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.501 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . 72.8 mt -133.62 153.33 51.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.336 -0.393 . . . . 74.420000000000002 110.674 -175.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.762 HH11 ' HG ' ' A' ' 77' ' ' LEU . 43.1 mtp180 -126.31 135.36 51.41 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.895 -0.409 . . . . 70.0 109.895 174.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.535 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.7 tt0 -68.77 110.47 4.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.04 -0.527 . . . . 74.209999999999994 109.711 177.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.5 tp -88.82 -52.18 5.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 111.131 -174.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 2.4 pt? -151.41 149.12 28.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.568 -0.287 . . . . 74.540000000000006 110.46 179.2 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -139.59 137.34 35.28 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.979 -0.378 . . . . 74.120000000000005 109.979 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.1 t -156.39 -175.7 5.57 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.143 -0.481 . . . . 73.530000000000001 109.973 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -106.78 -3.19 20.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.012 0.434 . . . . 71.109999999999999 110.614 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -107.28 134.75 49.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.959 -0.564 . . . . 74.310000000000002 111.252 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -93.76 -17.31 23.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.096 -0.502 . . . . 50.130000000000003 110.941 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t -65.24 -53.24 42.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-O 120.926 0.393 . . . . 74.019999999999996 110.451 -178.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.91 -34.48 78.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.189 -0.459 . . . . 74.010000000000005 110.732 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 66.7 mt -66.94 -32.03 73.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.447 -0.342 . . . . 51.399999999999999 111.032 179.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.9 m -67.52 -28.5 67.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.063 0.459 . . . . 74.150000000000006 110.333 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.465 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.87 -42.16 61.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.095 -0.502 . . . . 75.129999999999995 109.926 174.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.603 HG12 HD21 ' A' ' 84' ' ' LEU . 92.6 t -63.17 -45.35 98.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.646 -0.706 . . . . 61.100000000000001 110.721 176.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.47 -40.57 96.36 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.811 -0.632 . . . . 63.409999999999997 112.478 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.44 -33.43 74.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 72.439999999999998 111.184 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 87.2 mt -69.51 -51.28 37.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.147 0.498 . . . . 65.409999999999997 110.223 178.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.95 -47.19 81.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.699 -0.682 . . . . 70.329999999999998 110.815 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -66.65 -29.22 69.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 72.349999999999994 110.246 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.55 -28.56 73.11 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 121.094 -0.574 . . . . 65.430000000000007 112.32 178.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -96.45 11.8 33.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.852 0.358 . . . . 74.409999999999997 110.504 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.9 t70 66.86 19.64 10.64 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.561 -0.745 . . . . 74.049999999999997 110.89 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.9 mt -84.46 113.35 23.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.267 -0.424 . . . . 74.219999999999999 109.985 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.26 120.74 23.9 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 115.915 -0.584 . . . . 63.030000000000001 112.431 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -109.27 136.33 48.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.78 0.324 . . . . 75.439999999999998 110.841 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -94.38 94.77 8.46 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.007 -0.738 . . . . 62.229999999999997 109.007 176.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.424 HG21 HG22 ' A' ' 70' ' ' VAL . 20.7 t -127.78 104.86 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.728 -0.669 . . . . 62.32 110.17 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -104.67 115.03 29.63 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.365 -0.606 . . . . 73.030000000000001 109.365 177.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -88.2 127.96 35.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.24 0.543 . . . . 62.219999999999999 109.976 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -112.24 94.11 4.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.961 -0.563 . . . . 54.009999999999998 109.743 -178.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 56.7 m-80 -124.25 119.41 29.26 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.845 -0.616 . . . . 74.219999999999999 110.995 -176.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 21.8 ttt -93.49 -63.12 1.24 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.964 -0.754 . . . . 75.420000000000002 108.964 174.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.7 m -161.32 143.68 12.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.323 -0.853 . . . . 74.540000000000006 108.899 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.6 tt -75.55 84.98 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.97 0.89 . . . . 63.329999999999998 110.436 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.5 tp -112.01 104.67 12.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.126 -0.943 . . . . 72.150000000000006 110.039 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 56.05 78.91 0.18 Allowed 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.801 0.688 . . . . 64.120000000000005 111.264 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.55 35.3 3.64 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.95 -0.643 . . . . 55.25 112.624 -176.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.1 m -107.69 23.17 14.88 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.471 0.653 . . . . 64.430000000000007 109.601 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.9 tp -133.9 143.74 48.44 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.178 -0.919 . . . . 75.510000000000005 109.401 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.85 78.27 0.64 Allowed Glycine 0 C--N 1.33 0.25 0 C-N-CA 121.029 -0.605 . . . . 35.229999999999997 112.533 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.666 HG13 HG12 ' A' ' 66' ' ' ILE . 23.0 t -103.69 146.28 11.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 110.255 -0.276 . . . . 75.010000000000005 110.255 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.666 HG12 HG13 ' A' ' 65' ' ' VAL . 46.1 mm 70.0 97.41 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.398 0 O-C-N 123.737 0.648 . . . . 71.310000000000002 111.602 177.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -75.63 97.03 1.07 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.823 2.349 . . . . 75.519999999999996 111.262 176.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.601 ' HA ' ' NE ' ' A' ' 68' ' ' ARG . 2.6 mmp_? -92.9 136.22 33.45 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.228 -0.442 . . . . 74.040000000000006 111.234 -176.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.1 ptt180 -145.02 144.99 31.31 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.753 -0.658 . . . . 70.340000000000003 111.0 -178.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.424 HG22 HG21 ' A' ' 51' ' ' VAL . 53.7 t -105.71 127.42 60.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.906 -0.588 . . . . 73.329999999999998 110.245 179.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.535 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 7.6 mp -113.27 137.78 50.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.153 -0.476 . . . . 75.099999999999994 110.337 178.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.7 m -104.8 160.78 5.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.051 -0.522 . . . . 72.230000000000004 110.572 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.412 ' HA ' HD22 ' A' ' 23' ' ' LEU . 70.8 m-70 -84.47 40.81 0.8 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.512 -0.313 . . . . 75.319999999999993 111.585 -176.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 67.69 -173.2 0.19 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.806 -0.634 . . . . 63.509999999999998 112.401 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.544 ' HA ' ' HB3' ' A' ' 16' ' ' ASN . 27.2 t70 68.57 -70.76 0.13 Allowed 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 114.678 -1.146 . . . . 72.150000000000006 112.538 177.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.18 40.22 0.54 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.832 0.349 . . . . 71.219999999999999 111.746 -175.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.762 ' HG ' HH11 ' A' ' 24' ' ' ARG . 3.7 mm? -64.29 -49.98 69.69 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.737 -0.468 . . . . 63.32 109.737 175.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.72 -33.46 70.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.852 -0.613 . . . . 73.109999999999999 110.304 178.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.46 -52.48 48.81 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.891 -0.671 . . . . 71.239999999999995 112.138 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.42 86.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.472 0.177 . . . . 60.329999999999998 111.17 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -57.4 -48.82 78.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.487 -0.324 . . . . 64.010000000000005 111.352 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -67.51 -37.29 82.59 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 121.024 -0.27 . . . . 74.340000000000003 110.77 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 60.0 tp -60.62 -51.35 69.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.039 0.447 . . . . 73.109999999999999 110.52 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.603 HD21 HG12 ' A' ' 38' ' ' VAL . 10.5 mp -64.6 -33.79 76.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.907 -0.588 . . . . 73.329999999999998 111.326 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.837 ' HA ' ' HB3' ' A' ' 90' ' ' ALA . 95.3 m -66.92 -44.04 81.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.345 -0.389 . . . . 73.430000000000007 110.639 178.168 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -68.04 -35.29 78.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 74.430000000000007 110.136 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.57 -44.77 93.19 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.765 -0.652 . . . . 75.010000000000005 111.16 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 127.21 -14.78 6.52 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.228 -0.987 . . . . 73.230000000000004 113.602 175.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.484 HD12 ' HG ' ' A' ' 84' ' ' LEU . 1.6 pp -94.79 19.32 10.27 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.321 0.489 . . . . 64.310000000000002 112.321 -175.362 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.837 ' HB3' ' HA ' ' A' ' 85' ' ' THR . . . -68.63 84.54 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.94 0.4 . . . . 74.319999999999993 110.51 176.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -145.77 -48.05 0.22 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.839 -0.618 . . . . 74.040000000000006 109.883 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -79.87 -7.63 58.83 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.021 0.439 . . . . 72.140000000000001 110.543 -179.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.802 HD11 ' HA ' ' A' ' 90' ' ' ALA . 7.1 mp -67.09 134.83 52.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.891 -0.595 . . . . 73.030000000000001 110.094 178.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -131.99 112.59 12.52 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.094 0.473 . . . . 54.240000000000002 110.869 -177.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 49.1 m -118.47 107.37 13.72 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.731 -0.47 . . . . 63.539999999999999 109.731 175.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -76.52 132.97 39.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.273 -0.421 . . . . 73.150000000000006 110.493 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.6 t70 . . . . . 0 C--O 1.247 0.969 0 O-C-N 124.192 0.932 . . . . 74.150000000000006 109.851 -177.397 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 120.769 0.319 . . . . 72.549999999999997 110.337 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 95.25 89.69 1.74 Allowed Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.915 -0.659 . . . . 64.209999999999994 111.594 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.3 m -70.36 104.7 2.78 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.026 0.441 . . . . 73.340000000000003 110.733 -178.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 p -120.15 129.53 54.18 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 116.002 -0.544 . . . . 70.25 111.174 -177.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -147.48 20.62 1.19 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.635 -0.712 . . . . 73.349999999999994 109.677 174.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.9 m80 -109.53 116.94 32.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.042 -0.981 . . . . 75.430000000000007 110.744 179.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -132.66 116.76 17.05 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.844 -0.798 . . . . 72.010000000000005 108.844 170.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -142.86 126.44 16.87 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.871 -0.604 . . . . 72.400000000000006 111.091 -169.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -176.91 154.76 1.15 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.956 -0.565 . . . . 74.409999999999997 110.217 174.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -153.31 89.12 1.33 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.19 0.519 . . . . 72.129999999999995 109.682 175.318 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.3 p -75.07 143.27 43.53 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.771 -0.649 . . . . 72.140000000000001 111.091 -175.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.4 m -144.78 96.33 2.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 74.099999999999994 110.231 178.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -177.72 127.52 1.19 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 121.011 -0.614 . . . . 62.409999999999997 111.675 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -151.22 -31.12 0.17 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.915 0.388 . . . . 75.540000000000006 110.642 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -83.33 125.28 31.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.335 -0.393 . . . . 70.400000000000006 110.042 178.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.9 p-10 -148.9 65.25 1.04 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.477 0.656 . . . . 71.310000000000002 110.737 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.5 mp -99.34 116.23 31.04 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.842 -0.617 . . . . 71.219999999999999 110.21 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -77.28 80.91 3.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.275 0.559 . . . . 74.549999999999997 110.909 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -134.63 83.76 2.06 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.589 -0.732 . . . . 72.530000000000001 110.238 177.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -93.62 -17.76 22.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.373 0.606 . . . . 74.510000000000005 110.098 177.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.417 ' O ' ' HB3' ' A' ' 22' ' ' HIS . . . -104.19 -172.32 25.15 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.897 -0.881 . . . . 61.020000000000003 110.897 177.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.417 ' HB3' ' O ' ' A' ' 21' ' ' GLY . 44.6 t60 73.25 121.03 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.113 0.483 . . . . 64.420000000000002 110.545 178.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.1 mp -112.7 146.41 38.76 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.301 -0.408 . . . . 71.519999999999996 110.524 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -113.66 144.42 42.94 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.705 -0.48 . . . . 72.140000000000001 109.705 175.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.519 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 80.3 tt0 -77.11 110.59 11.91 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.783 -1.191 . . . . 72.239999999999995 107.783 172.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.547 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -79.92 -52.62 7.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.941 -0.572 . . . . 62.539999999999999 110.075 -173.011 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.633 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 2.1 pt? -152.52 150.72 29.88 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.735 -0.666 . . . . 75.450000000000003 109.491 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.474 ' HD2' ' OE2' ' A' ' 25' ' ' GLU . 8.7 ptm85 -132.53 121.56 23.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.282 0.563 . . . . 72.230000000000004 110.206 176.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.8 t -119.25 168.87 10.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.507 -0.77 . . . . 73.129999999999995 110.625 -175.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -117.05 7.96 13.24 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.54 -0.541 . . . . 73.430000000000007 109.54 174.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -105.38 142.43 35.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.4 -0.818 . . . . 72.430000000000007 110.134 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.423 ' HA ' HD13 ' A' ' 35' ' ' LEU . . . -94.94 -24.4 16.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.453 -0.339 . . . . 74.340000000000003 111.63 -175.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.5 t -77.99 -36.37 21.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.142 0.496 . . . . 71.340000000000003 110.137 -176.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.6 tp -61.16 -34.61 75.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.589 -0.732 . . . . 75.310000000000002 110.304 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.729 HD11 ' HG3' ' A' ' 68' ' ' ARG . 87.7 mt -63.26 -35.45 80.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.88 -0.6 . . . . 64.450000000000003 110.885 178.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.0 m -68.29 -27.66 66.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.218 0.532 . . . . 75.340000000000003 110.632 178.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.18 -51.11 8.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.852 -0.613 . . . . 72.129999999999995 110.804 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.467 HG13 ' HA ' ' A' ' 35' ' ' LEU . 9.8 p -65.8 -34.26 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.25 -0.432 . . . . 72.219999999999999 110.514 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.21 -48.03 83.0 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 121.08 -0.581 . . . . 63.119999999999997 112.557 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.72 -25.26 67.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.107 0.48 . . . . 74.010000000000005 111.243 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.537 ' HB3' HD22 ' A' ' 83' ' ' LEU . 94.4 mt -75.6 -52.37 10.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.055 -0.52 . . . . 73.049999999999997 110.075 177.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.27 -49.15 75.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.748 -0.66 . . . . 75.129999999999995 111.104 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.488 ' CG ' ' HE2' ' A' ' 49' ' ' HIS . 25.9 m-20 -63.6 -28.17 69.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.396 -0.365 . . . . 71.040000000000006 110.803 -178.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -73.44 -18.56 79.41 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.799 -0.715 . . . . 54.539999999999999 112.573 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -114.41 15.43 17.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.707 0.262 . . . . 63.43 111.707 -176.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.9 t70 71.45 7.35 6.01 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.426 0.631 . . . . 73.129999999999995 111.544 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 58.5 mt -70.96 112.09 5.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.169 -0.469 . . . . 74.409999999999997 111.01 -176.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -64.68 130.95 37.22 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.844 -0.616 . . . . 51.219999999999999 112.015 177.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.488 ' HE2' ' CG ' ' A' ' 43' ' ' ASP . 19.6 p80 -138.41 147.35 43.25 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.708 0.289 . . . . 72.129999999999995 110.769 -177.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.472 HD11 ' HB2' ' A' ' 71' ' ' LEU . 77.3 mt -82.8 -65.92 0.95 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.092 -0.503 . . . . 74.099999999999994 110.996 176.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 54.5 t 64.15 78.9 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.875 0.845 . . . . 63.32 110.602 -177.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 pp -170.92 -166.18 0.47 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.491 -1.231 . . . . 72.140000000000001 107.776 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -167.66 -82.86 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.404 -0.591 . . . . 71.140000000000001 109.404 172.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.3 tm0? -103.5 107.17 17.9 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.346 -0.983 . . . . 75.310000000000002 108.346 174.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -73.68 121.36 20.62 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.707 -0.479 . . . . 73.109999999999999 109.707 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.577 ' HB3' ' HA3' ' A' ' 61' ' ' GLY . 23.4 ptt? -51.29 113.28 0.9 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.458 0.647 . . . . 71.340000000000003 110.191 178.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.7 ' HB2' HD12 ' A' ' 58' ' ' ILE . 19.7 m -109.49 -61.14 1.68 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.498 -0.774 . . . . 75.219999999999999 111.568 -171.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.7 HD12 ' HB2' ' A' ' 57' ' ' SER . 4.8 mp -94.55 -73.9 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.98 0.419 . . . . 73.319999999999993 111.415 -171.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 68.1 tp -121.84 -53.51 1.96 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.424 -0.353 . . . . 72.150000000000006 111.797 -171.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.78 160.07 16.26 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.34 0.591 . . . . 72.219999999999999 111.464 -172.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.577 ' HA3' ' HB3' ' A' ' 56' ' ' MET . . . 161.37 14.56 0.03 OUTLIER Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 114.773 -1.103 . . . . 74.019999999999996 111.441 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 32.6 p -139.93 -39.94 0.45 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.935 0.346 . . . . 75.25 111.935 -177.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -72.89 -42.51 63.52 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.731 0.3 . . . . 71.140000000000001 111.227 -176.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.45 -178.81 46.18 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.038 -0.601 . . . . 72.439999999999998 112.559 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.0 t -97.01 93.38 3.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.179 0.514 . . . . 75.219999999999999 109.979 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.3 mp -92.31 119.49 68.1 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.777 -0.647 . . . . 63.539999999999999 109.773 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -63.64 167.31 13.69 Favored 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.901 2.401 . . . . 73.450000000000003 111.89 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.729 ' HG3' HD11 ' A' ' 35' ' ' LEU . 13.3 mmt85 -130.02 122.52 28.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.186 -0.301 . . . . 72.400000000000006 110.186 -177.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.722 ' HD3' HD13 ' A' ' 71' ' ' LEU . 1.8 ptp180 -112.66 136.44 52.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.196 0.522 . . . . 74.299999999999997 110.402 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 48.2 t -106.97 111.64 36.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.991 -0.55 . . . . 52.340000000000003 110.162 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.722 HD13 ' HD3' ' A' ' 69' ' ' ARG . 7.6 mp -104.62 139.78 38.97 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.34 -0.391 . . . . 75.409999999999997 110.253 177.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.8 m -130.27 168.68 22.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 O-C-N 123.73 0.644 . . . . 74.450000000000003 110.038 177.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 -82.38 163.22 21.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.292 -0.413 . . . . 74.120000000000005 110.83 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -59.45 -27.07 65.74 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.293 -0.412 . . . . 62.530000000000001 110.169 174.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -43.41 -59.12 2.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.218 -0.901 . . . . 74.5 111.781 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -116.79 35.42 4.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.181 -0.463 . . . . 74.340000000000003 110.31 -175.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.497 ' O ' ' HG3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -59.71 -53.89 52.69 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.363 -0.606 . . . . 73.120000000000005 109.363 178.675 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.48 -30.34 69.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.977 -0.556 . . . . 71.140000000000001 110.704 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.87 -49.32 49.36 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.802 -0.635 . . . . 62.32 112.389 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.75 -39.51 93.75 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.387 0.137 . . . . 62.399999999999999 110.71 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 77' ' ' LEU . 73.5 mtp180 -57.66 -47.92 80.94 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 110.088 -0.338 . . . . 73.129999999999995 110.088 175.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 82' ' ' ARG . 3.8 tpp180 -58.12 -50.9 71.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.79 -0.641 . . . . 73.219999999999999 110.494 178.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.537 HD22 ' HB3' ' A' ' 41' ' ' LEU . 55.7 tp -58.35 -52.18 66.69 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.529 -0.76 . . . . 75.209999999999994 111.856 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.98 -33.43 73.68 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.624 0.25 . . . . 73.420000000000002 111.643 -177.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.953 ' HA ' ' HB1' ' A' ' 90' ' ' ALA . 53.4 m -73.3 -36.67 66.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.1 0.476 . . . . 63.340000000000003 110.633 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -74.53 -32.79 62.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.83 -0.623 . . . . 74.209999999999994 110.3 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.57 96.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.776 -0.647 . . . . 72.5 111.807 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 150.94 -47.4 0.59 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 119.76 -1.21 . . . . 73.010000000000005 113.622 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.818 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -53.58 -75.77 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.7 0.25 . . . . 74.230000000000004 111.504 -175.014 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.953 ' HB1' ' HA ' ' A' ' 85' ' ' THR . . . 42.2 38.89 1.24 Allowed 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.573 0.582 . . . . 63.219999999999999 112.573 178.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 29.5 t-80 -132.78 -46.44 0.87 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.385 0.612 . . . . 73.510000000000005 110.375 -176.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -71.09 -13.25 61.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.038 -0.983 . . . . 73.030000000000001 110.892 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.633 ' HA ' ' HB3' ' A' ' 27' ' ' LEU . 6.7 mp -66.13 96.0 0.31 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.881 -0.6 . . . . 72.450000000000003 110.131 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -178.67 135.28 0.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.043 -0.526 . . . . 72.040000000000006 110.577 -172.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 21.5 m -159.1 -47.24 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.844 0.354 . . . . 73.420000000000002 111.819 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -80.78 6.26 13.49 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.209 0.528 . . . . 73.219999999999999 111.421 -174.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.3 t70 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 117.979 -1.01 . . . . 65.329999999999998 110.217 -177.337 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttt . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.169 0.509 . . . . 71.109999999999999 110.109 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -174.97 54.71 0.13 Allowed Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 110.865 -0.894 . . . . 64.340000000000003 110.865 178.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.4 p -90.77 -4.52 56.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.49 -0.355 . . . . 73.549999999999997 111.888 -173.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.2 p -76.35 71.86 3.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.114 0.483 . . . . 74.310000000000002 112.238 -175.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -163.35 121.22 1.92 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.139 0.495 . . . . 75.299999999999997 111.49 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -118.56 -113.81 0.33 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 107.434 -1.321 . . . . 74.329999999999998 107.434 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 62.91 28.44 16.34 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.174 0.512 . . . . 63.030000000000001 111.815 166.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -114.48 105.39 13.05 Favored 'General case' 0 C--N 1.329 -0.31 0 O-C-N 121.699 -0.626 . . . . 72.140000000000001 111.558 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.4 p80 -160.81 126.63 3.9 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.917 -0.401 . . . . 60.439999999999998 109.917 170.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.4 t-160 -160.31 70.08 0.41 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.226 0.536 . . . . 70.340000000000003 109.689 178.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 p -99.38 101.36 12.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.738 -0.664 . . . . 61.219999999999999 110.607 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.6 m -152.2 86.27 1.29 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.334 -0.394 . . . . 63.420000000000002 110.558 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -132.6 37.27 2.05 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.858 -0.687 . . . . 74.5 111.938 179.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -101.97 36.0 2.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.082 0.468 . . . . 75.030000000000001 110.218 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -83.67 115.65 22.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.754 -0.657 . . . . 70.230000000000004 110.458 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -171.02 85.85 0.1 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.615 -0.721 . . . . 62.030000000000001 109.307 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -159.37 106.95 1.76 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.762 -0.829 . . . . 71.450000000000003 108.762 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -157.87 95.25 1.39 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.918 0.389 . . . . 72.430000000000007 110.869 -177.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -97.03 104.91 16.97 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.396 -0.594 . . . . 72.140000000000001 109.396 175.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -90.49 137.15 32.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.185 0.517 . . . . 74.329999999999998 110.901 -175.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.65 -139.19 4.36 Favored Glycine 0 N--CA 1.442 -0.903 0 N-CA-C 110.39 -1.084 . . . . 62.130000000000003 110.39 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -143.09 -170.12 3.18 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 117.024 0.412 . . . . 73.329999999999998 110.3 175.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.44 ' HB3' HD23 ' A' ' 71' ' ' LEU . 95.3 mt -58.03 116.94 3.83 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.212 -0.449 . . . . 62.030000000000001 111.555 -175.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 50.3 mmm-85 -106.09 132.99 51.51 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.722 -0.672 . . . . 74.040000000000006 109.87 177.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.549 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 22.3 tt0 -80.31 110.69 15.99 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.291 -0.633 . . . . 74.200000000000003 109.291 -179.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.654 ' HB3' HD22 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -84.62 -55.0 4.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.051 -0.522 . . . . 71.140000000000001 110.667 -172.597 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.747 ' HB3' HD23 ' A' ' 93' ' ' LEU . 1.2 pt? -142.59 153.99 44.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.14 -0.482 . . . . 72.329999999999998 110.689 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -139.98 130.8 25.97 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.324 -0.853 . . . . 71.319999999999993 109.07 -178.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.0 t -167.11 175.5 7.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.118 -0.327 . . . . 60.439999999999998 110.118 178.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -119.53 4.07 11.17 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.368 -0.378 . . . . 64.319999999999993 110.202 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -85.6 108.27 17.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 64.239999999999995 110.353 -178.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.62 -35.91 81.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.728 -0.669 . . . . 75.430000000000007 111.52 -176.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 50.7 t -62.06 -51.95 66.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.911 0.386 . . . . 65.129999999999995 110.437 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.548 HD13 HD11 ' A' ' 89' ' ' LEU . 32.9 tp -64.45 -42.13 96.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.989 -0.55 . . . . 72.219999999999999 110.853 -179.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.1 mt -59.35 -38.95 81.69 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.778 0.323 . . . . 60.200000000000003 111.201 178.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 m -66.43 -38.72 88.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.918 0.39 . . . . 74.200000000000003 110.496 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.29 -46.52 80.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 63.329999999999998 110.288 177.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.543 HG13 HD21 ' A' ' 84' ' ' LEU . 95.5 t -59.59 -43.54 91.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 65.420000000000002 110.751 178.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.22 -43.68 97.01 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.985 -0.626 . . . . 74.219999999999999 111.918 178.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.47 -36.08 82.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.721 0.296 . . . . 71.430000000000007 110.886 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 94.2 mt -65.35 -52.29 54.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.004 0.431 . . . . 63.520000000000003 110.395 178.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.0 mt -64.53 -36.73 85.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.808 -0.633 . . . . 75.239999999999995 110.859 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -65.1 -39.96 93.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.029 -0.532 . . . . 72.109999999999999 110.305 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.61 -21.43 74.67 Favored Glycine 0 CA--C 1.518 0.239 0 CA-C-N 115.804 -0.635 . . . . 73.349999999999994 112.876 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -101.63 0.66 36.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.957 0.408 . . . . 65.430000000000007 110.338 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 t70 59.59 30.09 19.7 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.27 -0.877 . . . . 74.219999999999999 111.253 178.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 65.2 mt -79.67 114.83 21.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-N 115.962 -0.563 . . . . 72.319999999999993 110.158 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.21 110.87 2.71 Favored Glycine 0 N--CA 1.453 -0.195 0 CA-C-N 116.06 -0.518 . . . . 71.430000000000007 112.183 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 54.2 p-80 -131.36 137.86 48.92 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.71 0.29 . . . . 73.120000000000005 110.808 -175.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 92.8 mt -112.63 146.55 38.42 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.665 -0.495 . . . . 73.540000000000006 109.665 177.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.601 HG21 ' HG ' ' A' ' 52' ' ' LEU . 16.7 m -140.25 -164.22 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.486 -0.325 . . . . 74.109999999999999 110.452 -176.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.601 ' HG ' HG21 ' A' ' 51' ' ' VAL . 96.5 mt 75.89 -168.78 0.08 Allowed 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.926 0.766 . . . . 61.32 111.744 175.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -177.17 -56.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 107.939 -1.134 . . . . 74.549999999999997 107.939 -179.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -134.69 137.59 43.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.388 -1.278 . . . . 75.329999999999998 108.426 170.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -119.36 153.86 34.48 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.029 0.442 . . . . 74.519999999999996 111.39 -175.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 50.6 ttp -171.43 150.02 2.79 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.5 -0.926 . . . . 61.0 108.5 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 61.8 m -62.46 126.82 28.64 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.754 -0.378 . . . . 74.439999999999998 110.077 174.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.437 ' O ' ' HB2' ' A' ' 59' ' ' LEU . 38.5 mm -82.32 -21.39 9.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 73.040000000000006 110.447 -175.542 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' A' ' 58' ' ' ILE . 57.2 mt 70.28 -74.92 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.03 -0.987 . . . . 53.409999999999997 111.192 -178.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -168.38 -28.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.448 -0.342 . . . . 74.129999999999995 111.051 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 176.98 127.36 1.04 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.571 -0.823 . . . . 73.209999999999994 112.383 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.0 t -159.45 165.31 33.38 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.505 -0.554 . . . . 73.400000000000006 109.505 178.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.0 mp -84.41 113.8 21.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.991 0.424 . . . . 73.239999999999995 110.764 -178.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.99 98.07 0.2 Allowed Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 120.908 -0.663 . . . . 43.539999999999999 111.761 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -95.14 122.05 46.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.9 -0.407 . . . . 64.209999999999994 109.9 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.3 mp -84.42 119.51 73.14 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.335 -0.393 . . . . 64.400000000000006 109.973 179.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -61.85 102.27 0.24 Allowed 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.761 2.307 . . . . 52.409999999999997 111.656 177.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 40.3 ttm180 -105.58 112.48 25.58 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.647 -0.706 . . . . 74.510000000000005 110.212 -176.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.407 ' HG3' ' OE1' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -115.39 158.97 21.7 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.007 -0.542 . . . . 62.509999999999998 109.842 176.799 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.418 ' HA ' HG12 ' A' ' 51' ' ' VAL . 21.4 t -109.24 118.09 55.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.406 -0.361 . . . . 74.239999999999995 110.747 -175.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.549 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.3 mp -107.88 132.49 53.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.206 -0.452 . . . . 71.420000000000002 109.794 177.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.3 m -92.77 142.86 12.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 120.878 0.37 . . . . 64.349999999999994 110.738 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -88.18 61.2 6.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 74.230000000000004 110.477 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 55.85 -169.25 0.09 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.215 -0.902 . . . . 64.439999999999998 112.217 178.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.4 t70 64.32 -72.59 0.06 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.924 0.889 . . . . 71.239999999999995 112.328 177.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.598 ' OD1' ' HA3' ' A' ' 79' ' ' GLY . 0.4 OUTLIER -88.93 36.53 0.81 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.187 0.517 . . . . 73.019999999999996 110.577 -175.473 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.39 -51.18 70.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.617 -0.719 . . . . 75.310000000000002 110.419 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.41 -27.72 62.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.714 -0.675 . . . . 63.32 110.244 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.598 ' HA3' ' OD1' ' A' ' 76' ' ' ASP . . . -61.67 -52.87 47.94 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.649 -0.705 . . . . 72.120000000000005 112.424 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.96 97.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.629 0.252 . . . . 71.439999999999998 111.088 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 81.4 mtp180 -59.16 -41.85 89.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.094 0.473 . . . . 72.0 110.63 178.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.405 ' HE ' ' HA ' ' A' ' 82' ' ' ARG . 0.3 OUTLIER -68.89 -49.62 56.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.621 -0.718 . . . . 72.540000000000006 110.809 179.545 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 49.6 tp -56.27 -48.99 75.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.519 -0.764 . . . . 74.510000000000005 112.074 -173.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.543 HD21 HG13 ' A' ' 38' ' ' VAL . 11.1 mp -67.66 -27.37 66.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.651 -0.249 . . . . 74.019999999999996 111.211 -178.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.758 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.2 m -70.97 -43.48 67.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.396 -0.365 . . . . 74.239999999999995 110.264 175.114 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -62.77 -39.79 95.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.999 -0.546 . . . . 72.099999999999994 110.764 176.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.86 -43.47 85.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.801 -0.636 . . . . 75.409999999999997 111.465 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 140.08 -43.37 1.14 Allowed Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 119.939 -1.124 . . . . 73.200000000000003 113.433 176.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.881 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -58.93 -75.94 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.654 0.242 . . . . 74.219999999999999 111.654 -175.299 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.881 ' H ' ' HG ' ' A' ' 89' ' ' LEU . . . 44.69 44.46 7.49 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 122.772 0.429 . . . . 54.420000000000002 111.548 -177.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -116.55 -56.02 2.32 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.893 -0.323 . . . . 74.239999999999995 111.467 -173.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -76.81 10.25 2.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.299 -0.41 . . . . 73.120000000000005 111.235 -177.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.747 HD23 ' HB3' ' A' ' 27' ' ' LEU . 63.2 mt -80.52 117.8 21.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.433 . . . . 70.129999999999995 110.273 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -99.64 79.17 2.22 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.226 -0.657 . . . . 73.219999999999999 109.226 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -63.14 -31.15 72.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.38 -0.827 . . . . 63.43 111.497 -175.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -167.14 -38.46 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.158 0.504 . . . . 73.200000000000003 110.362 179.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.591 -0.718 . . . . 73.239999999999995 110.313 -178.281 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttp . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.76 0.314 . . . . 62.240000000000002 110.542 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.24 86.59 1.86 Allowed Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.8 -0.714 . . . . 72.329999999999998 111.707 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.1 m -116.06 118.56 33.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.779 0.323 . . . . 55.399999999999999 110.844 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.6 m -104.39 114.07 28.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.638 -0.504 . . . . 43.329999999999998 109.638 176.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -137.84 105.78 5.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.238 0.542 . . . . 73.420000000000002 111.624 -176.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -142.99 95.0 2.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.45 -0.795 . . . . 73.310000000000002 109.802 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -75.14 149.52 39.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.467 -0.788 . . . . 75.519999999999996 110.904 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -167.91 128.94 1.41 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.218 0.532 . . . . 73.310000000000002 111.061 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.5 p-80 -145.22 75.92 1.46 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.795 0.807 . . . . 71.420000000000002 109.754 175.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -81.54 87.59 6.23 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.737 -0.665 . . . . 73.340000000000003 111.571 -171.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.1 m -130.67 123.57 29.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.851 -0.796 . . . . 72.25 108.851 173.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.3 t -135.92 104.31 5.68 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.484 0.55 . . . . 72.409999999999997 112.484 -175.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 72.37 -167.53 53.23 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.285 -0.871 . . . . 75.120000000000005 114.917 167.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -172.99 -176.62 1.44 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.508 -0.846 . . . . 65.530000000000001 108.981 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -143.96 153.13 41.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.354 -0.239 . . . . 75.329999999999998 110.354 177.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -161.82 115.69 1.89 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.099 -0.5 . . . . 71.129999999999995 109.794 -179.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.2 mt -114.11 100.77 8.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.174 0.511 . . . . 71.510000000000005 112.066 -175.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -127.37 149.36 50.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.708 -0.678 . . . . 74.420000000000002 109.618 171.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -137.67 131.1 30.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.971 0.415 . . . . 63.109999999999999 110.754 178.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 47.3 tp60 -168.05 87.89 0.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.107 -0.701 . . . . 72.239999999999995 109.107 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.7 78.01 0.24 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.88 -0.676 . . . . 72.349999999999994 113.818 -171.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -141.25 169.88 16.77 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.806 -0.813 . . . . 72.430000000000007 108.806 172.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.544 HD23 HD11 ' A' ' 50' ' ' LEU . 5.8 mp -130.61 130.35 43.88 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.85 -0.426 . . . . 75.030000000000001 109.85 176.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -122.06 169.27 11.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.299 -0.41 . . . . 75.109999999999999 110.218 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -67.89 120.72 14.64 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.28 -0.418 . . . . 63.340000000000003 111.384 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.615 HD11 HD22 ' A' ' 27' ' ' LEU . 1.8 tm? -74.62 -36.41 62.94 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 107.254 -1.388 . . . . 64.319999999999993 107.254 169.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.615 HD22 HD11 ' A' ' 26' ' ' LEU . 2.5 pt? -176.81 159.99 1.84 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.186 -0.915 . . . . 71.540000000000006 110.195 -175.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.442 ' NH1' ' HB3' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -110.07 112.02 23.74 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.081 -1.081 . . . . 74.439999999999998 108.081 170.125 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.636 HG21 ' H ' ' A' ' 32' ' ' ALA . 11.2 m -85.13 109.22 18.11 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.104 -0.498 . . . . 74.439999999999998 111.237 -171.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.442 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.6 OUTLIER -90.51 -15.04 31.49 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.125 -0.694 . . . . 74.340000000000003 109.125 176.569 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -73.14 -32.48 64.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.12 -0.945 . . . . 71.430000000000007 110.873 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.636 ' H ' HG21 ' A' ' 29' ' ' THR . . . 74.25 -40.27 0.45 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.703 0.801 . . . . 73.299999999999997 112.586 178.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.1 t -78.91 -39.99 22.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.051 0.453 . . . . 75.319999999999993 110.805 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 55.5 tp -52.79 -39.84 62.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.681 -0.691 . . . . 63.119999999999997 112.266 -178.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 4.5 pp -65.23 -25.2 67.58 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 111.651 0.241 . . . . 73.019999999999996 111.651 -175.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.1 m -70.67 -34.03 71.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.099 0.476 . . . . 74.040000000000006 109.958 178.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.33 -40.91 50.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.974 -0.557 . . . . 73.25 110.044 176.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.46 HG11 HD22 ' A' ' 84' ' ' LEU . 75.1 t -57.24 -36.34 51.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 115.606 -0.725 . . . . 75.319999999999993 110.799 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.99 -46.03 95.41 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.596 -0.729 . . . . 70.439999999999998 112.433 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.34 -26.6 65.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.913 0.387 . . . . 72.409999999999997 111.201 -179.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.32 -52.12 13.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.395 -0.366 . . . . 74.230000000000004 110.977 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.527 HD21 HD21 ' A' ' 83' ' ' LEU . 63.7 mt -69.45 -39.45 77.76 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.218 -0.446 . . . . 75.239999999999995 111.401 -175.053 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -30.54 60.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.586 -0.279 . . . . 60.219999999999999 111.117 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.51 -26.67 73.6 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.038 -0.601 . . . . 72.200000000000003 111.796 177.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.45 5.58 46.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.597 0.237 . . . . 64.549999999999997 110.876 178.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.1 t70 70.61 7.68 6.3 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.84 -0.618 . . . . 74.030000000000001 111.217 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.0 mt -75.2 -45.36 41.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.254 0.549 . . . . 63.119999999999997 110.696 -178.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.01 148.21 23.86 Favored Glycine 0 C--N 1.315 -0.588 0 CA-C-N 115.285 -0.871 . . . . 54.25 111.854 -179.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -142.66 139.78 31.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.291 -0.263 . . . . 74.319999999999993 110.291 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.544 HD11 HD23 ' A' ' 23' ' ' LEU . 71.0 mt -119.02 106.73 12.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.826 0.346 . . . . 73.340000000000003 110.469 175.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.585 HG21 HG22 ' A' ' 70' ' ' VAL . 59.0 t -84.71 112.78 22.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.046 -0.724 . . . . 75.349999999999994 109.046 174.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 50.3 tp -105.94 114.39 28.51 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.021 -0.536 . . . . 73.219999999999999 110.834 -175.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.408 ' CB ' ' HG2' ' A' ' 68' ' ' ARG . 8.5 p-10 -155.94 -170.22 3.33 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.311 -0.859 . . . . 75.329999999999998 109.279 176.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -99.88 100.2 11.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.025 0.441 . . . . 64.019999999999996 109.998 179.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -81.96 35.61 0.43 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.033 -0.53 . . . . 74.209999999999994 111.412 -174.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.401 ' HG2' ' O ' ' A' ' 56' ' ' MET . 22.3 ttt -155.18 20.24 0.43 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.186 0.517 . . . . 63.229999999999997 110.516 179.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.3 m -75.1 113.0 11.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.092 0.473 . . . . 72.510000000000005 110.533 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 5.4 tp -114.03 103.51 15.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.775 0.797 . . . . 74.219999999999999 110.653 -179.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.401 HD22 ' HA ' ' A' ' 59' ' ' LEU . 1.0 OUTLIER -122.8 130.68 53.19 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.324 -0.991 . . . . 74.299999999999997 108.324 177.87 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -65.2 97.51 0.26 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.646 0.736 . . . . 74.530000000000001 111.602 -178.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 139.13 156.69 7.06 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.353 -0.839 . . . . 51.299999999999997 111.842 178.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.5 m -96.69 82.76 3.35 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.374 0.607 . . . . 73.519999999999996 110.34 179.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.6 tp -139.5 116.24 10.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.515 -0.766 . . . . 72.129999999999995 109.953 -177.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.88 102.45 2.14 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.864 -0.684 . . . . 40.25 111.968 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.4 t -116.39 -0.05 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.361 0.6 . . . . 71.510000000000005 110.327 -178.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.0 mp -101.47 107.67 52.09 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 74.420000000000002 110.212 -178.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.2 93.22 0.89 Allowed 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.407 2.072 . . . . 75.340000000000003 111.464 176.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.408 ' HG2' ' CB ' ' A' ' 53' ' ' ASP . 86.7 mtt180 -72.58 133.55 44.77 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.707 -0.679 . . . . 64.109999999999999 110.223 -177.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 57.2 mtt85 -113.97 135.1 54.37 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.999 -0.546 . . . . 72.329999999999998 111.765 -171.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.585 HG22 HG21 ' A' ' 51' ' ' VAL . 45.0 t -101.98 116.55 45.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.913 -0.585 . . . . 73.209999999999994 109.666 177.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mp -101.95 142.98 32.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.793 0.33 . . . . 75.430000000000007 110.546 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.415 HG21 ' HB2' ' A' ' 26' ' ' LEU . 3.0 t -126.29 154.25 35.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.9 -0.591 . . . . 45.109999999999999 109.882 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -59.14 139.06 57.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.99 -0.55 . . . . 73.540000000000006 109.637 174.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -57.53 156.43 8.16 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.969 -0.292 . . . . 71.310000000000002 110.387 178.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 28.7 t70 73.05 -47.5 0.67 Allowed 'General case' 0 N--CA 1.468 0.471 0 O-C-N 123.935 0.772 . . . . 54.530000000000001 110.376 -173.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -73.85 -16.13 61.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.787 -0.82 . . . . 74.409999999999997 108.787 175.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.417 HD23 HD23 ' A' ' 26' ' ' LEU . 1.1 tm? -55.57 -45.83 77.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.524 -1.216 . . . . 72.209999999999994 109.659 174.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.06 -38.16 89.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 74.420000000000002 110.987 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.62 -44.41 82.13 Favored Glycine 0 C--N 1.329 0.181 0 C-N-CA 120.971 -0.633 . . . . 70.049999999999997 111.829 177.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.54 -39.78 85.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.77 0.319 . . . . 63.340000000000003 110.683 177.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.4 mtp180 -55.35 -52.91 61.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.89 -0.596 . . . . 75.329999999999998 110.947 176.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -62.3 -43.49 98.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 75.329999999999998 110.754 -177.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.527 HD21 HD21 ' A' ' 42' ' ' LEU . 50.1 tp -59.28 -47.11 86.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.641 -0.708 . . . . 74.450000000000003 111.035 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.46 HD22 HG11 ' A' ' 38' ' ' VAL . 66.4 mt -72.01 -26.11 62.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.073 -0.512 . . . . 75.340000000000003 111.588 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 56.4 m -68.0 -48.3 66.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.584 -0.28 . . . . 75.040000000000006 110.423 176.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -65.64 -42.09 91.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.86 0.362 . . . . 73.439999999999998 110.698 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -119.42 82.21 1.84 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.099 0.476 . . . . 72.239999999999995 111.136 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 154.3 -95.69 0.15 Allowed Glycine 0 N--CA 1.44 -1.091 0 N-CA-C 111.384 -0.686 . . . . 34.130000000000003 111.384 178.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.568 HD12 ' N ' ' A' ' 90' ' ' ALA . 1.7 pp 175.12 -35.28 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.763 0.425 . . . . 64.140000000000001 110.662 -177.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . 0.568 ' N ' HD12 ' A' ' 89' ' ' LEU . . . 48.39 54.12 10.9 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.707 -0.679 . . . . 61.299999999999997 112.185 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -99.8 -34.64 10.07 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.642 0.258 . . . . 75.5 110.879 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.484 ' HA ' ' HB2' ' A' ' 96' ' ' ASP . 43.9 mt-10 -82.09 24.44 0.65 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.344 -0.389 . . . . 71.0 111.786 -175.433 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.422 HD22 ' HB3' ' A' ' 90' ' ' ALA . 94.2 mt -50.09 117.51 2.38 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.372 0.42 . . . . 72.510000000000005 111.83 -175.084 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.2 mtt180 64.01 -78.47 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 O-C-N 124.048 0.842 . . . . 74.329999999999998 110.947 -172.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 8.9 p -138.52 134.67 34.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.277 -0.42 . . . . 73.209999999999994 110.157 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . 0.484 ' HB2' ' HA ' ' A' ' 92' ' ' GLU . 13.3 t70 -103.69 6.23 36.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.664 0.745 . . . . 75.510000000000005 109.533 179.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.423 ' CG ' HH21 ' A' ' 28' ' ' ARG . 35.8 m-20 . . . . . 0 C--O 1.248 0.981 0 CA-C-N 114.994 -1.003 . . . . 71.140000000000001 109.564 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.0 mtp . . . . . 0 N--CA 1.478 0.968 0 CA-C-O 120.714 0.293 . . . . 72.530000000000001 110.531 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 117.64 90.02 1.42 Allowed Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.821 -0.704 . . . . 50.350000000000001 111.968 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.6 p -66.61 158.08 30.81 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.884 0.374 . . . . 75.530000000000001 110.78 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 m -76.2 97.49 4.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.936 0.398 . . . . 74.319999999999993 110.722 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -90.33 93.64 9.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 53.530000000000001 109.899 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -123.02 99.27 6.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.181 -0.463 . . . . 72.510000000000005 110.11 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 74.9 m-70 -110.49 169.41 8.76 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.067 -0.716 . . . . 73.420000000000002 109.067 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -153.56 130.83 11.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.262 0.554 . . . . 73.25 111.097 178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -142.99 113.12 7.17 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.445 -0.798 . . . . 45.32 109.101 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -103.68 112.03 24.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.035 0.445 . . . . 73.310000000000002 110.652 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.1 m -150.65 117.94 6.02 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.714 -0.676 . . . . 62.530000000000001 110.406 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -134.68 88.7 2.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.078 -0.51 . . . . 64.439999999999998 109.928 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -131.67 58.0 0.71 Allowed Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 111.373 -0.691 . . . . 40.310000000000002 111.373 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.89 76.3 8.71 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.638 -0.504 . . . . 71.299999999999997 109.638 -176.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.89 -0.595 . . . . 74.099999999999994 110.736 -177.678 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.7 mt . . . . . 0 C--O 1.231 0.129 0 CA-C-O 121.028 0.442 . . . . 65.209999999999994 111.649 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.891 ' HB2' HD21 ' A' ' 77' ' ' LEU . 50.7 mtt180 -134.4 148.03 50.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.974 -0.557 . . . . 72.439999999999998 109.729 173.022 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.84 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 25.1 tt0 -81.94 136.58 35.29 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.038 -0.528 . . . . 70.109999999999999 110.701 -177.11 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.676 HD11 HG22 ' A' ' 72' ' ' VAL . 11.2 mp -106.77 -65.86 1.06 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.634 0.254 . . . . 63.329999999999998 111.521 -179.12 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -147.0 177.21 9.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.733 0.301 . . . . 74.140000000000001 110.925 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' HB ' ' A' ' 29' ' ' THR . 6.2 ptp180 -148.46 154.28 39.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.319 -0.4 . . . . 73.109999999999999 110.223 -178.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.461 HG21 HD23 ' A' ' 34' ' ' LEU . 12.2 t 178.29 163.61 0.7 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.377 0.423 . . . . 74.239999999999995 110.121 176.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -113.95 -0.17 14.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.009 0.433 . . . . 74.430000000000007 109.834 175.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -73.77 116.51 14.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.755 -0.657 . . . . 72.129999999999995 110.576 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.56 -33.8 74.48 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.55 -0.75 . . . . 54.210000000000001 112.239 -176.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 65.7 t -72.34 -47.53 52.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.818 0.342 . . . . 72.049999999999997 110.25 -178.114 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.461 HD23 HG21 ' A' ' 29' ' ' THR . 40.2 tp -61.38 -40.83 95.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 75.129999999999995 110.426 178.17 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.581 HD13 ' HD2' ' A' ' 68' ' ' ARG . 69.9 mt -65.26 -29.17 69.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.959 -0.564 . . . . 72.549999999999997 111.356 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.1 m -76.05 -39.08 56.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.715 0.293 . . . . 62.530000000000001 110.528 177.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.457 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -64.43 -53.89 41.33 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.194 -0.457 . . . . 70.219999999999999 110.935 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.8 t -60.53 -38.25 77.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.066 -0.515 . . . . 63.5 110.884 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.55 -48.39 82.14 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.897 -0.592 . . . . 70.299999999999997 111.918 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.63 -34.66 77.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.714 0.293 . . . . 62.109999999999999 111.629 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 96.2 mt -64.6 -51.48 62.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.14 -0.482 . . . . 75.030000000000001 110.639 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.13 -41.36 74.02 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.93 -0.577 . . . . 74.109999999999999 110.984 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.74 -39.44 91.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.899 -0.591 . . . . 74.120000000000005 110.821 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.0 -25.04 71.95 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.122 -0.561 . . . . 72.109999999999999 112.822 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -102.05 7.98 41.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.542 0.211 . . . . 70.129999999999995 111.412 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.8 t70 61.41 30.55 18.98 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.539 0.685 . . . . 74.140000000000001 110.903 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.59 HG21 ' HB2' ' A' ' 80' ' ' ALA . 72.0 mt -85.13 121.18 36.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.298 -0.41 . . . . 62.0 110.347 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -62.63 107.98 1.89 Allowed Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.5 -0.64 . . . . 64.400000000000006 111.5 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' VAL . 52.1 p-80 -126.72 166.65 16.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.91 0.386 . . . . 61.310000000000002 111.48 -173.194 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.5 tp -138.58 104.61 5.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.347 -0.842 . . . . 71.120000000000005 109.676 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.595 HG12 HG22 ' A' ' 70' ' ' VAL . 29.5 m . . . . . 0 C--N 1.323 -0.565 0 CA-C-O 121.506 0.669 . . . . 62.140000000000001 110.141 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo . . . . . 0 N--CA 1.453 -0.874 0 CA-C-O 120.764 0.235 . . . . 71.239999999999995 112.08 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.581 ' HD2' HD13 ' A' ' 35' ' ' LEU . 66.3 mtt180 -104.39 160.61 14.77 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.121 -0.326 . . . . 71.439999999999998 110.121 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.8 ptt180 -133.68 140.8 47.27 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.64 -0.504 . . . . 72.129999999999995 109.64 176.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.595 HG22 HG12 ' A' ' 51' ' ' VAL . 48.5 t -103.63 116.38 47.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.907 -0.588 . . . . 60.0 111.253 -173.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.84 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.4 mp -117.84 162.14 18.59 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.107 -0.701 . . . . 75.019999999999996 109.107 173.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.676 HG22 HD11 ' A' ' 26' ' ' LEU . 35.2 m -137.34 167.41 23.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 120.824 0.345 . . . . 53.140000000000001 110.104 174.406 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -73.13 137.55 45.24 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.223 -0.658 . . . . 63.219999999999999 109.223 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.816 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 40.9 mt-10 -65.26 -11.15 38.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.657 0.265 . . . . 72.200000000000003 111.584 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -55.59 -39.25 70.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.605 0.717 . . . . 75.200000000000003 110.009 171.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -129.43 33.81 4.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.338 -0.846 . . . . 70.129999999999995 110.215 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.891 HD21 ' HB2' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -56.52 -57.08 13.9 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.656 -0.702 . . . . 64.129999999999995 110.415 -177.67 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.49 70.36 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.841 -0.618 . . . . 61.25 110.996 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -68.97 -46.77 58.24 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 121.183 -0.532 . . . . 73.140000000000001 112.659 -178.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.59 ' HB2' HG21 ' A' ' 47' ' ' ILE . . . -63.58 -44.4 94.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.739 0.304 . . . . 63.530000000000001 110.862 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 57.2 mtp85 -67.39 -33.32 74.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.443 . . . . 73.230000000000004 110.401 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -62.01 -47.29 85.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.829 -0.623 . . . . 73.329999999999998 109.788 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.5 tp -60.37 -53.19 60.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 75.329999999999998 110.981 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.47 -28.81 68.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.12 -0.491 . . . . 62.219999999999999 112.001 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.768 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 47.4 m -85.26 -48.66 8.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.812 0.339 . . . . 71.349999999999994 111.213 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -74.19 -43.88 55.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.223 -0.444 . . . . 72.230000000000004 111.9 -173.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.54 29.99 4.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.853 0.359 . . . . 64.129999999999995 111.662 -174.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -121.35 -80.0 0.56 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.182 -1.009 . . . . 65.540000000000006 112.306 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.47 HD12 ' N ' ' A' ' 90' ' ' ALA . 1.8 pp -167.58 -44.5 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.873 -0.163 . . . . 75.319999999999993 111.273 -177.004 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.768 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 55.96 94.67 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.724 0.64 . . . . 70.239999999999995 111.704 -178.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -157.64 -64.96 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.523 -0.471 . . . . 72.120000000000005 111.234 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -87.52 16.87 5.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.211 -0.45 . . . . 74.450000000000003 111.824 -172.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 98.8 mt -73.72 126.17 29.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.131 0.491 . . . . 71.530000000000001 111.615 -175.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 115.468 -0.787 . . . . 61.030000000000001 109.152 178.064 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.7 ttp . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 110.176 -0.305 . . . . 74.450000000000003 110.176 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.62 119.24 2.63 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.684 -0.769 . . . . 63.399999999999999 111.993 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.3 t -139.12 97.81 3.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.155 0.502 . . . . 72.25 109.693 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 t -89.78 85.47 6.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.331 -0.618 . . . . 52.43 109.331 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.8 p-80 -131.51 70.77 1.46 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.558 0.694 . . . . 74.420000000000002 110.291 -177.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -125.93 87.54 2.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.641 0.734 . . . . 70.310000000000002 110.828 -178.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.6 p-80 -126.03 37.91 4.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.754 -0.657 . . . . 75.319999999999993 109.848 176.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -70.91 77.94 0.64 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.7 -0.852 . . . . 73.219999999999999 108.7 175.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 37.7 t-80 -122.19 107.85 12.63 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.408 -0.814 . . . . 71.5 109.694 -173.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -130.28 95.43 3.9 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.561 -0.533 . . . . 62.450000000000003 109.561 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.6 t -129.49 113.97 15.54 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.169 -0.469 . . . . 62.130000000000003 109.775 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.2 t -151.3 112.19 4.27 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.183 -0.462 . . . . 61.329999999999998 110.266 178.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 84.38 65.26 1.53 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.908 -0.663 . . . . 63.43 112.7 177.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.42 ' HD2' ' OD1' ' A' ' 76' ' ' ASP . 51.2 ttp85 -77.25 94.91 4.21 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.869 -0.789 . . . . 74.299999999999997 108.869 177.005 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 116.214 -0.448 . . . . 72.329999999999998 112.021 -171.445 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.627 HD13 HD22 ' A' ' 50' ' ' LEU . 14.1 mt . . . . . 0 N--CA 1.452 -0.36 0 N-CA-C 110.084 -0.339 . . . . 73.299999999999997 110.084 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.623 ' HB2' HD21 ' A' ' 77' ' ' LEU . 17.5 mmt180 -113.84 133.38 55.45 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.228 -0.442 . . . . 73.439999999999998 110.419 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.663 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 29.6 tt0 -64.83 109.06 1.94 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.721 -0.844 . . . . 71.030000000000001 108.721 175.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.7 tp -87.16 -54.81 4.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.425 -0.352 . . . . 74.099999999999994 110.811 -172.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.58 157.06 43.21 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.282 -0.417 . . . . 73.109999999999999 110.102 177.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.428 ' HG3' ' HB3' ' A' ' 69' ' ' ARG . 39.9 ttp180 -142.73 119.95 11.51 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.628 -0.508 . . . . 72.400000000000006 109.628 179.502 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -148.91 160.55 43.16 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.107 -0.331 . . . . 64.109999999999999 110.107 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -107.56 10.28 29.26 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.395 -0.366 . . . . 71.349999999999994 110.531 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -92.51 107.51 19.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.382 -0.372 . . . . 72.150000000000006 110.066 177.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.98 -27.15 68.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.953 -0.567 . . . . 72.219999999999999 111.896 -175.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 44.2 t -66.85 -50.91 60.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.861 0.362 . . . . 73.340000000000003 110.477 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.716 HD11 HD22 ' A' ' 89' ' ' LEU . 23.1 tp -64.27 -38.68 91.91 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.979 -0.555 . . . . 63.509999999999998 110.323 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.458 HD13 ' HD2' ' A' ' 68' ' ' ARG . 77.7 mt -61.25 -32.9 72.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.96 -0.564 . . . . 62.039999999999999 111.047 177.131 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -70.02 -39.27 75.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.905 0.383 . . . . 61.119999999999997 110.559 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.508 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.19 -52.8 52.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 73.129999999999995 110.459 178.008 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.522 HG13 HD21 ' A' ' 84' ' ' LEU . 86.3 t -60.12 -40.36 83.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.895 -0.593 . . . . 72.010000000000005 110.428 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 43' ' ' ASP . . . -61.7 -49.32 77.56 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.601 -0.727 . . . . 54.149999999999999 112.264 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.37 -31.53 72.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.699 0.285 . . . . 73.120000000000005 111.295 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.701 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.7 mt -64.61 -51.75 61.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.219 -0.446 . . . . 74.400000000000006 110.702 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.1 mt -71.94 -40.05 68.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.104 -0.498 . . . . 45.420000000000002 110.832 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 39' ' ' GLY . 0.8 OUTLIER -66.5 -35.98 81.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.125 0.488 . . . . 71.219999999999999 110.35 -177.379 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -73.14 -35.51 57.24 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.855 -0.688 . . . . 63.109999999999999 112.378 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.15 -1.0 57.02 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.501 0.185 . . . . 73.340000000000003 111.501 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.4 t70 71.24 28.16 3.07 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.753 0.658 . . . . 55.530000000000001 110.857 177.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -84.02 128.31 38.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.167 -0.47 . . . . 73.439999999999998 110.193 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.81 110.82 3.7 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.064 -0.588 . . . . 65.239999999999995 111.978 -177.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -109.21 130.85 55.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.013 0.435 . . . . 74.140000000000001 111.436 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.627 HD22 HD13 ' A' ' 23' ' ' LEU . 60.8 tp -98.39 102.8 14.65 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.89 -0.782 . . . . 75.439999999999998 108.89 171.424 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.451 HG12 HG22 ' A' ' 70' ' ' VAL . 6.4 m . . . . . 0 C--N 1.322 -0.613 0 CA-C-N 116.127 -0.488 . . . . 74.400000000000006 110.553 -175.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo . . . . . 0 N--CA 1.46 -0.496 0 N-CA-C 111.092 -0.388 . . . . 70.109999999999999 111.092 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.458 ' HD2' HD13 ' A' ' 35' ' ' LEU . 27.7 ttm180 -66.8 122.69 18.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.036 -0.529 . . . . 73.25 110.289 -177.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.428 ' HB3' ' HG3' ' A' ' 28' ' ' ARG . 19.3 ptt180 -113.27 152.12 30.23 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.727 -0.669 . . . . 75.450000000000003 110.449 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.451 HG22 HG12 ' A' ' 51' ' ' VAL . 29.8 t -112.98 117.51 55.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.683 -0.689 . . . . 74.209999999999994 110.104 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.663 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 7.5 mp -107.86 137.7 45.4 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.013 -0.365 . . . . 71.150000000000006 110.013 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.487 HG23 HD22 ' A' ' 77' ' ' LEU . 14.5 m -132.39 166.07 30.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.143 -0.48 . . . . 61.109999999999999 110.338 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -76.07 156.56 33.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.434 -0.348 . . . . 74.010000000000005 110.451 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.638 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 57.7 mp0 -59.97 -21.89 61.8 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.324 -0.398 . . . . 73.450000000000003 110.908 174.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -52.19 -71.41 0.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.854 -0.612 . . . . 74.400000000000006 110.737 176.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.42 ' OD1' ' HD2' ' A' ' 14' ' ' ARG . 44.5 m-20 -91.38 18.0 7.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.657 -0.701 . . . . 64.329999999999998 110.653 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.638 ' HB2' ' HA ' ' A' ' 74' ' ' GLU . 0.3 OUTLIER -56.87 -51.18 70.07 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.559 -0.534 . . . . 70.510000000000005 109.559 179.242 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.59 -32.48 72.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.602 -0.727 . . . . 62.130000000000003 110.991 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.42 -45.96 43.94 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.069 -0.586 . . . . 74.430000000000007 112.334 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.6 -40.21 95.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.59 0.233 . . . . 54.240000000000002 110.558 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -59.13 -45.03 91.99 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.847 0.356 . . . . 62.509999999999998 110.132 175.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.47 -50.9 72.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.779 -0.646 . . . . 74.099999999999994 110.553 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.701 HD21 ' HB3' ' A' ' 41' ' ' LEU . 55.8 tp -58.61 -52.96 63.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.772 -0.649 . . . . 71.230000000000004 111.257 -177.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.522 HD21 HG13 ' A' ' 38' ' ' VAL . 85.6 mt -66.54 -28.26 68.4 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.226 -0.443 . . . . 72.319999999999993 111.944 -177.482 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.863 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 90.6 m -82.45 -50.18 9.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.826 0.346 . . . . 64.450000000000003 111.14 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -72.93 -44.13 61.56 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.338 0.495 . . . . 75.310000000000002 112.338 -173.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -121.76 7.26 9.93 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.827 0.677 . . . . 73.209999999999994 112.827 -172.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -111.41 -74.96 0.76 Allowed Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 119.915 -1.136 . . . . 71.310000000000002 112.288 -178.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.716 HD22 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -172.61 -51.89 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.526 0.203 . . . . 74.299999999999997 111.203 -172.357 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.863 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 59.2 82.98 0.14 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.905 -0.589 . . . . 54.43 110.74 -172.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -158.79 -44.59 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.03 0.443 . . . . 74.109999999999999 110.796 -176.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -89.91 11.11 21.35 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.071 -0.513 . . . . 71.120000000000005 110.819 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 90.9 mt -71.17 133.0 45.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 63.109999999999999 110.911 -176.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 115.798 -0.637 . . . . 73.510000000000005 110.679 178.659 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.835 0.35 . . . . 53.109999999999999 110.207 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 81.3 -172.4 53.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.751 -0.738 . . . . 52.420000000000002 111.783 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.0 p -141.08 148.28 39.92 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.005 0.402 . . . . 72.439999999999998 110.784 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.2 p -87.0 133.19 33.6 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.041 -0.527 . . . . 71.120000000000005 110.563 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -124.34 116.26 22.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.512 0.672 . . . . 71.540000000000006 111.231 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -145.33 106.57 4.19 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.289 -0.869 . . . . 63.549999999999997 109.715 175.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -127.75 107.25 9.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.488 -0.324 . . . . 73.230000000000004 111.26 -176.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -144.27 146.45 32.64 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.401 -0.592 . . . . 71.010000000000005 109.401 172.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -156.02 118.42 4.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.131 0.491 . . . . 73.450000000000003 111.673 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -145.45 94.17 2.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.74 0.781 . . . . 62.399999999999999 109.923 168.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.1 t -130.65 102.18 6.01 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.356 -0.838 . . . . 64.219999999999999 109.493 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.7 t -149.35 155.34 40.35 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.485 -0.561 . . . . 64.230000000000004 109.485 -176.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 158.97 99.1 0.15 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.909 -0.663 . . . . 74.030000000000001 111.881 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -95.24 -26.91 15.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.917 0.389 . . . . 75.019999999999996 110.487 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 . . . . . 0 C--N 1.327 -0.41 0 CA-C-O 121.222 0.534 . . . . 72.239999999999995 110.326 -179.718 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 73' ' ' HIS . 8.5 mp . . . . . 0 N--CA 1.45 -0.435 0 N-CA-C 109.057 -0.72 . . . . 62.509999999999998 109.057 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -105.3 142.52 34.93 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.407 -0.361 . . . . 73.140000000000001 110.229 -177.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.785 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 28.9 tt0 -76.12 109.07 9.48 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.472 -0.936 . . . . 75.329999999999998 108.472 176.308 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.422 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -81.82 -70.17 0.56 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.131 -0.486 . . . . 75.400000000000006 112.04 -169.9 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.499 ' HB2' ' O ' ' A' ' 92' ' ' GLU . 0.9 OUTLIER -142.38 170.28 15.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.192 0.52 . . . . 74.340000000000003 112.225 -169.645 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.564 ' O ' ' HB3' ' A' ' 92' ' ' GLU . 6.4 ptp180 -138.34 158.04 45.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.881 -1.054 . . . . 73.530000000000001 109.0 177.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.8 t -161.21 163.03 31.4 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.05 -0.352 . . . . 62.32 110.05 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -116.02 11.41 15.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.141 -0.481 . . . . 75.129999999999995 110.363 -174.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.401 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 28.4 t70 -120.41 135.51 55.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.168 -0.469 . . . . 72.109999999999999 111.223 -177.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.21 -31.78 64.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.82 -0.627 . . . . 65.430000000000007 111.522 -176.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.4 t -69.87 -43.43 79.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.621 -0.511 . . . . 71.450000000000003 109.621 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.401 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 9.2 mp -58.84 -48.35 81.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.571 -0.741 . . . . 72.109999999999999 110.846 175.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.6 mt -52.79 -41.72 64.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.929 -0.578 . . . . 75.299999999999997 111.381 175.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.9 m -72.71 -41.63 65.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.226 -0.443 . . . . 65.409999999999997 111.092 -178.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -64.05 -54.22 37.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.481 -0.327 . . . . 51.119999999999997 110.649 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.696 HG13 HD22 ' A' ' 84' ' ' LEU . 87.8 t -61.02 -40.46 85.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.147 0.499 . . . . 75.319999999999993 110.607 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.17 -52.04 50.43 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 115.702 -0.681 . . . . 71.019999999999996 112.528 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.33 -31.8 67.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.671 0.272 . . . . 61.219999999999999 111.485 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 94.2 mt -63.15 -51.24 67.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.334 -0.394 . . . . 61.350000000000001 110.341 177.328 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.4 mt -68.25 -36.8 80.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.836 -0.62 . . . . 73.439999999999998 110.652 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -64.4 -46.84 81.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 71.010000000000005 110.53 177.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.47 -36.97 93.25 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.794 -0.639 . . . . 62.509999999999998 112.93 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.97 -10.72 59.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.012 0.434 . . . . 74.519999999999996 110.81 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.4 t70 70.32 23.71 4.96 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 115.061 -0.972 . . . . 63.210000000000001 110.635 178.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.9 mt -74.32 -39.34 48.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.701 -0.682 . . . . 71.140000000000001 109.485 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.19 110.68 0.33 Allowed Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 114.928 -1.033 . . . . 70.209999999999994 112.077 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -91.71 150.79 20.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.826 0.346 . . . . 60.509999999999998 110.884 -177.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.4 tp -114.09 87.31 2.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.785 -0.82 . . . . 71.129999999999995 108.785 170.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.694 HG12 HG22 ' A' ' 70' ' ' VAL . 6.3 m . . . . . 0 C--N 1.323 -0.549 0 CA-C-O 121.521 0.677 . . . . 62.009999999999998 110.892 -176.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo . . . . . 0 C--O 1.234 0.321 0 CA-C-O 120.793 0.247 . . . . 74.400000000000006 111.854 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -69.0 139.81 55.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.321 -0.4 . . . . 74.230000000000004 110.222 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 63.2 mtt180 -114.1 155.22 26.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.198 -0.455 . . . . 74.299999999999997 110.275 -176.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.694 HG22 HG12 ' A' ' 51' ' ' VAL . 31.6 t -113.02 120.83 64.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.254 -0.43 . . . . 72.420000000000002 110.356 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.785 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.8 mp -114.89 143.52 45.0 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.609 0.242 . . . . 64.239999999999995 110.826 177.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.0 m -142.35 160.84 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 116.179 -0.464 . . . . 74.230000000000004 110.112 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.519 ' HA ' ' HA ' ' A' ' 23' ' ' LEU . 2.0 p-80 -72.48 143.3 48.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.149 0.499 . . . . 74.310000000000002 111.255 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.898 ' HA ' HD23 ' A' ' 77' ' ' LEU . 31.1 tt0 -57.1 -37.01 71.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.056 -0.974 . . . . 63.229999999999997 113.059 -169.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -64.17 -18.95 64.96 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.33 0.492 . . . . 63.020000000000003 112.33 -171.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -117.12 15.22 15.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.019 0.438 . . . . 73.129999999999995 110.869 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.898 HD23 ' HA ' ' A' ' 74' ' ' GLU . 0.6 OUTLIER -58.96 -41.12 86.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.744 -0.662 . . . . 54.43 110.451 177.383 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.07 -40.33 80.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.913 -0.585 . . . . 75.219999999999999 111.187 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.91 -47.3 25.73 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.58 -0.819 . . . . 61.130000000000003 112.268 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.462 ' O ' ' HG ' ' A' ' 84' ' ' LEU . . . -63.07 -41.82 99.53 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.717 0.266 . . . . 65.549999999999997 111.717 -177.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -58.84 -47.75 83.76 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 120.574 0.226 . . . . 75.510000000000005 110.887 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -56.52 -45.15 81.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.2 0.524 . . . . 75.120000000000005 110.372 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 45.1 tp -64.9 -52.04 58.64 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.474 -0.785 . . . . 74.430000000000007 111.256 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.696 HD22 HG13 ' A' ' 38' ' ' VAL . 76.2 mt -70.41 -28.05 64.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.114 -0.494 . . . . 73.450000000000003 111.883 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.902 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.8 m -75.5 -49.49 18.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.645 0.26 . . . . 53.329999999999998 110.755 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -75.34 -44.15 46.81 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.042 0.386 . . . . 71.519999999999996 112.042 -174.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -115.04 20.15 15.24 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.152 0.427 . . . . 73.340000000000003 112.152 -173.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -125.84 -80.51 0.38 Allowed Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 120.176 -1.011 . . . . 73.219999999999999 111.527 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.618 HD12 ' N ' ' A' ' 90' ' ' ALA . 0.9 OUTLIER 176.77 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.763 0.425 . . . . 73.340000000000003 111.302 -176.827 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.902 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 65.12 7.05 3.83 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.165 0.802 . . . . 75.129999999999995 113.165 177.39 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -85.49 -33.95 21.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.923 0.392 . . . . 64.400000000000006 110.941 -177.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.564 ' HB3' ' O ' ' A' ' 28' ' ' ARG . 5.7 mm-40 -80.85 1.17 31.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.716 -0.674 . . . . 75.219999999999999 111.161 -174.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 83.7 mt -66.6 115.37 6.38 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.232 -0.44 . . . . 65.540000000000006 111.62 -174.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.422 ' H ' ' HA ' ' A' ' 27' ' ' LEU . 22.3 ttt180 . . . . . 0 N--CA 1.463 0.219 0 CA-C-N 114.916 -1.038 . . . . 75.349999999999994 111.879 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 120.768 0.318 . . . . 70.120000000000005 110.46 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.12 113.89 0.31 Allowed Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.028 -0.606 . . . . 21.440000000000001 111.824 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.4 m -108.18 152.75 24.15 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.418 -0.586 . . . . 62.420000000000002 109.418 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.5 m -77.08 85.93 3.57 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.183 0.516 . . . . 64.120000000000005 110.103 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -89.43 73.42 7.89 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.668 0.747 . . . . 73.230000000000004 110.022 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -145.72 145.16 30.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.262 -0.881 . . . . 75.540000000000006 109.792 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -131.04 114.92 15.78 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.975 -0.557 . . . . 63.450000000000003 109.837 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -79.14 144.73 34.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.863 0.363 . . . . 72.219999999999999 110.527 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -159.53 122.58 3.6 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.459 -0.571 . . . . 63.109999999999999 109.459 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -117.67 114.31 23.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.078 0.466 . . . . 75.109999999999999 110.361 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.9 m -152.52 85.8 1.26 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.616 -0.72 . . . . 62.530000000000001 109.676 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.9 t -162.81 150.85 13.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.768 -0.651 . . . . 33.009999999999998 109.56 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 149.66 149.99 5.14 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.821 -0.704 . . . . 64.030000000000001 112.11 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 70.1 mtp180 -134.92 -175.52 3.93 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.626 0.25 . . . . 75.439999999999998 110.334 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 . . . . . 0 C--N 1.323 -0.573 0 CA-C-N 116.029 -0.532 . . . . 64.340000000000003 109.944 175.823 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 N--CA 1.454 -0.229 0 CA-C-O 120.688 0.28 . . . . 75.230000000000004 110.285 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.46 ' HB2' HD21 ' A' ' 77' ' ' LEU . 28.4 mmm-85 -133.35 133.84 43.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.039 -0.528 . . . . 74.310000000000002 110.149 -176.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.588 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 71.8 tt0 -68.59 114.74 7.24 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.529 -0.545 . . . . 63.329999999999998 109.529 173.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.508 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -84.72 -54.7 4.53 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.705 -0.48 . . . . 74.319999999999993 109.705 -175.89 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.571 HD11 HG21 ' A' ' 38' ' ' VAL . 2.1 pt? -148.27 160.7 42.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.149 0.5 . . . . 55.140000000000001 110.956 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.499 ' HG3' ' HG2' ' A' ' 69' ' ' ARG . 51.6 ttt180 -141.23 122.7 15.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.469 -0.787 . . . . 71.129999999999995 109.58 -178.117 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 t -150.26 177.81 9.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.675 0.274 . . . . 74.530000000000001 110.296 -177.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -124.67 -4.03 7.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.126 -0.488 . . . . 71.519999999999996 110.903 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -85.49 125.12 32.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.939 0.4 . . . . 75.219999999999999 110.769 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.6 -41.07 80.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.628 -0.715 . . . . 74.549999999999997 111.677 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.2 t -63.36 -43.26 98.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-O 121.277 0.561 . . . . 73.329999999999998 110.819 -176.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.53 ' CD2' ' HG3' ' A' ' 92' ' ' GLU . 47.6 tp -62.3 -44.46 96.47 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.791 -0.64 . . . . 53.439999999999998 110.798 178.225 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 68.2 mt -59.41 -39.56 83.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 75.150000000000006 111.266 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.7 m -62.47 -38.72 90.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.837 0.351 . . . . 64.120000000000005 110.958 178.355 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.455 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -66.83 -48.72 68.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 63.25 110.634 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.571 HG21 HD11 ' A' ' 27' ' ' LEU . 60.4 t -61.32 -39.92 84.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.971 -0.559 . . . . 51.409999999999997 110.6 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.64 -45.59 95.4 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.109 -0.567 . . . . 64.420000000000002 112.46 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.63 -28.98 69.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.904 0.383 . . . . 71.439999999999998 111.388 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 93.3 mt -73.6 -51.47 16.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.141 -0.481 . . . . 63.049999999999997 110.333 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.0 mt -66.66 -39.36 88.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.784 -0.644 . . . . 70.530000000000001 111.11 -176.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -70.18 -36.87 74.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.779 0.323 . . . . 72.310000000000002 110.784 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.45 -32.26 78.7 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.689 -0.767 . . . . 73.450000000000003 112.526 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.06 11.78 26.43 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.504 0.192 . . . . 72.040000000000006 111.466 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.7 t70 59.26 30.15 19.84 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 122.016 0.912 . . . . 70.030000000000001 110.812 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 60.3 mt -83.97 -44.7 18.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.685 -0.688 . . . . 72.010000000000005 109.791 178.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.1 139.34 5.85 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.036 -0.983 . . . . 71.349999999999994 111.253 -175.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -123.75 117.14 24.26 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.101 0.477 . . . . 71.120000000000005 110.628 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.8 mt -101.71 96.51 7.14 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.781 -0.451 . . . . 74.319999999999993 109.781 176.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.7 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 30.6 m . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.097 -0.501 . . . . 64.540000000000006 110.228 178.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo . . . . . 0 N--CA 1.459 -0.514 0 CA-C-O 120.983 0.326 . . . . 75.329999999999998 111.941 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -87.72 133.43 33.85 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.563 -0.532 . . . . 70.099999999999994 109.563 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.7 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 60.1 mtp180 -120.03 137.94 53.8 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.779 -0.646 . . . . 45.25 109.722 -169.095 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.668 HG22 HG12 ' A' ' 51' ' ' VAL . 8.1 t -99.95 105.94 18.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.823 0.344 . . . . 72.310000000000002 110.728 -171.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.588 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 9.1 mp -104.2 127.7 51.84 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.126 -0.488 . . . . 54.009999999999998 110.58 177.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 29.7 m -109.56 -176.04 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.602 -0.726 . . . . 72.239999999999995 109.648 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -107.22 162.37 13.94 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.938 -0.305 . . . . 63.140000000000001 110.267 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -59.48 -22.73 62.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.407 0.622 . . . . 75.200000000000003 109.978 173.041 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -50.25 -36.18 30.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.477 -1.238 . . . . 51.420000000000002 112.684 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -141.49 30.59 1.72 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.853 0.358 . . . . 72.109999999999999 110.605 -175.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.46 HD21 ' HB2' ' A' ' 24' ' ' ARG . 0.2 OUTLIER -57.95 -47.4 83.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.05 0.453 . . . . 65.5 110.593 -177.081 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.29 -40.49 74.23 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.003 -0.544 . . . . 74.049999999999997 111.129 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -66.39 -48.21 65.19 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.903 -0.665 . . . . 74.239999999999995 112.157 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.71 -41.2 77.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.764 0.316 . . . . 71.450000000000003 110.815 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -59.12 -53.98 52.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.353 -0.385 . . . . 72.239999999999995 111.078 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -64.73 -38.21 90.2 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 121.175 -0.21 . . . . 71.409999999999997 111.265 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.3 tp -58.69 -47.98 82.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.077 0.465 . . . . 72.239999999999995 110.708 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.582 ' HG ' HD11 ' A' ' 89' ' ' LEU . 11.1 mp -72.89 -28.67 62.62 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.056 -0.52 . . . . 73.400000000000006 111.213 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.688 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 89.5 m -66.36 -46.14 77.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 110.358 -0.238 . . . . 31.34 110.358 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.62 -31.74 72.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.274 -0.421 . . . . 73.409999999999997 110.72 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.96 -27.06 67.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.067 0.461 . . . . 24.219999999999999 111.115 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.73 -15.83 59.27 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.801 -0.714 . . . . 73.109999999999999 112.493 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.582 HD11 ' HG ' ' A' ' 84' ' ' LEU . 3.2 pp -84.55 9.42 13.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.766 0.317 . . . . 73.200000000000003 111.366 -177.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.688 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . -65.65 86.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.131 0.491 . . . . 65.230000000000004 110.039 174.457 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -163.77 -37.23 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.4 -0.818 . . . . 71.109999999999999 110.009 -177.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.53 ' HG3' ' CD2' ' A' ' 34' ' ' LEU . 20.8 mm-40 -80.44 4.13 19.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.319 -0.401 . . . . 62.119999999999997 110.91 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.454 ' CD1' ' HA ' ' A' ' 90' ' ' ALA . 10.2 mp -65.61 142.85 57.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.058 -0.519 . . . . 61.109999999999999 111.16 -177.44 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? . . . . . 0 C--N 1.32 -0.688 0 CA-C-N 115.935 -0.575 . . . . 73.439999999999998 110.008 177.578 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 120.979 0.418 . . . . 74.409999999999997 110.34 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -119.74 42.47 1.75 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.444 -0.884 . . . . 60.530000000000001 112.107 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.0 m -140.19 91.17 2.43 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.068 0.461 . . . . 62.25 109.81 178.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 m -129.04 93.63 3.64 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.825 -0.625 . . . . 73.310000000000002 110.607 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -133.56 88.36 2.47 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.128 -0.487 . . . . 71.129999999999995 111.09 176.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -113.59 118.47 34.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.759 -0.655 . . . . 71.439999999999998 109.477 173.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -158.77 113.16 2.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.258 -0.428 . . . . 75.319999999999993 110.201 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -141.52 127.05 18.9 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.778 -0.647 . . . . 71.150000000000006 109.847 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -170.74 82.79 0.09 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.208 -0.451 . . . . 62.219999999999999 110.036 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -150.87 93.2 1.91 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.394 -0.366 . . . . 60.229999999999997 111.029 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.2 m -156.59 94.65 1.49 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.974 -0.557 . . . . 74.549999999999997 109.593 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.0 m -148.0 126.8 12.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.809 0.299 . . . . 54.219999999999999 111.809 -177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 92.69 130.4 5.31 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.119 -0.562 . . . . 55.32 114.189 170.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.72 157.27 37.8 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.231 -0.655 . . . . 74.150000000000006 109.231 170.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 C--N 1.321 -0.633 0 CA-C-O 121.072 0.463 . . . . 70.340000000000003 111.386 179.73 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mp . . . . . 0 C--O 1.23 0.071 0 N-CA-C 109.83 -0.433 . . . . 72.340000000000003 109.83 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -115.71 148.74 39.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.622 0.249 . . . . 65.239999999999995 111.263 -176.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.933 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.8 tt0 -84.13 121.4 27.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.957 -0.565 . . . . 62.420000000000002 110.51 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.436 ' CD1' HG22 ' A' ' 72' ' ' VAL . 9.8 mp -100.6 -66.21 0.92 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.803 0.668 . . . . 75.239999999999995 112.803 -173.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.619 ' CB ' ' HA ' ' A' ' 93' ' ' LEU . 2.4 pt? -142.25 169.22 18.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.18 0.514 . . . . 73.019999999999996 111.934 -171.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -100.87 136.19 41.11 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.089 -0.96 . . . . 73.010000000000005 109.443 176.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.8 p -117.74 92.32 3.81 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.539 0.685 . . . . 70.430000000000007 111.172 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 16.9 p-10 -111.54 9.53 21.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.817 0.818 . . . . 74.0 109.352 175.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.482 ' HB3' ' HB3' ' A' ' 34' ' ' LEU . 18.1 t70 -114.03 125.53 54.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.83 -1.077 . . . . 53.329999999999998 109.799 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.24 -44.02 97.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.19 -0.459 . . . . 73.439999999999998 111.602 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 46.9 t -70.76 -44.58 76.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.309 -0.405 . . . . 54.409999999999997 110.668 -176.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.602 HD22 ' HG3' ' A' ' 92' ' ' GLU . 29.2 tp -58.65 -42.74 89.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.969 -0.56 . . . . 71.209999999999994 111.204 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 64.8 tp -62.49 -35.79 80.48 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.176 -0.465 . . . . 62.439999999999998 110.875 -177.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.2 m -70.55 -42.38 71.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 54.240000000000002 110.648 176.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.72 -54.1 31.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 55.210000000000001 111.537 -177.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.491 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 87.1 t -62.7 -41.07 90.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.997 0.427 . . . . 64.340000000000003 110.662 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.36 -34.33 89.62 Favored Glycine 0 N--CA 1.453 -0.196 0 CA-C-N 115.784 -0.644 . . . . 64.420000000000002 112.489 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.57 -36.28 68.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 55.520000000000003 110.779 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 87.2 mt -65.74 -46.3 79.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.996 -0.547 . . . . 65.430000000000007 110.501 178.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 38' ' ' VAL . 85.7 mt -59.02 -47.77 84.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.577 -0.738 . . . . 64.349999999999994 110.559 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -68.56 -37.51 79.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.131 -0.486 . . . . 73.230000000000004 110.856 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.1 -20.76 67.36 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 115.788 -0.642 . . . . 50.130000000000003 113.182 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -109.68 7.97 24.6 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.802 -0.234 . . . . 75.430000000000007 111.218 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.7 t70 61.07 33.99 19.33 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.748 0.785 . . . . 72.239999999999995 110.665 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.928 HG23 ' HB3' ' A' ' 76' ' ' ASP . 84.8 mt -82.41 120.25 33.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.521 -0.763 . . . . 62.030000000000001 110.321 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.68 109.45 2.91 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.927 -0.654 . . . . 71.420000000000002 111.747 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -126.39 148.14 49.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.976 0.417 . . . . 72.310000000000002 111.065 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 65.5 tp -127.99 127.98 44.2 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.774 -0.648 . . . . 65.219999999999999 109.579 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.3 m . . . . . 0 C--N 1.318 -0.769 0 CA-C-O 120.989 0.423 . . . . 74.219999999999999 110.948 179.84 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo . . . . . 0 N--CA 1.461 -0.385 0 CA-C-O 120.465 0.111 . . . . 44.020000000000003 111.813 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 -58.96 136.89 58.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.505 -0.554 . . . . 72.219999999999999 109.505 175.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.403 ' HD3' ' OE2' ' A' ' 25' ' ' GLU . 74.3 mtt180 -113.35 139.45 48.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.853 0.358 . . . . 74.420000000000002 110.905 -175.095 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.4 t -105.38 118.49 52.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.02 -0.536 . . . . 62.119999999999997 110.68 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.933 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.9 mp -114.96 150.23 36.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.843 -0.617 . . . . 65.049999999999997 109.771 177.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.809 HG23 HD22 ' A' ' 77' ' ' LEU . 34.4 m -130.56 163.3 36.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.295 0.569 . . . . 72.019999999999996 111.233 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.44 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 41.2 t-80 -75.87 150.89 37.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.274 -0.875 . . . . 63.229999999999997 110.841 -176.307 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 24.4 mm-40 -38.74 -64.72 0.42 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.148 1.166 . . . . 73.030000000000001 114.148 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -67.38 -19.09 65.36 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.442 0.639 . . . . 65.030000000000001 110.963 -174.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.928 ' HB3' HG23 ' A' ' 47' ' ' ILE . 2.4 m-20 -85.73 -14.06 46.47 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.343 -0.844 . . . . 71.420000000000002 110.613 -176.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.809 HD22 HG23 ' A' ' 72' ' ' VAL . 1.6 mm? -52.72 -57.94 8.47 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.095 -0.502 . . . . 74.099999999999994 111.409 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.56 -42.88 83.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.996 -0.547 . . . . 55.140000000000001 111.056 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.42 -48.11 77.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.813 -0.708 . . . . 21.43 112.555 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.498 ' HB2' HG21 ' A' ' 47' ' ' ILE . . . -65.47 -47.31 76.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.648 0.261 . . . . 75.230000000000004 111.417 -178.012 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.539 ' HD2' HD12 ' A' ' 77' ' ' LEU . 39.3 mtp180 -64.44 -38.83 92.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.402 -0.363 . . . . 72.310000000000002 110.582 -177.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 82' ' ' ARG . 40.9 ttt-85 -66.42 -44.33 83.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.116 0.484 . . . . 64.200000000000003 110.389 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.4 tp -62.31 -47.52 83.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.586 -0.733 . . . . 73.519999999999996 111.283 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.87 -28.72 70.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 63.299999999999997 110.962 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.9 m -74.46 -39.15 62.7 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.827 0.346 . . . . 55.439999999999998 110.505 177.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -66.49 -37.02 84.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.024 0.44 . . . . 73.340000000000003 110.688 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.26 -17.27 52.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.971 -0.559 . . . . 74.310000000000002 111.172 178.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 78.16 28.54 55.92 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.863 -0.608 . . . . 73.200000000000003 112.796 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.8 mt -103.56 5.09 36.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.977 0.418 . . . . 74.019999999999996 110.639 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.819 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -76.22 73.03 3.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.297 0.57 . . . . 64.310000000000002 110.681 178.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -129.31 -34.24 1.86 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.759 -0.655 . . . . 63.140000000000001 110.407 179.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.602 ' HG3' HD22 ' A' ' 34' ' ' LEU . 51.7 mm-40 -98.18 8.7 44.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.582 -0.735 . . . . 75.019999999999996 111.011 -175.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.819 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.8 mp -80.99 121.34 25.92 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.822 -0.436 . . . . 65.400000000000006 109.822 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 . . . . . 0 N--CA 1.452 -0.343 0 CA-C-O 121.51 0.671 . . . . 65.019999999999996 110.327 -177.997 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.4 ttp . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.802 0.335 . . . . 74.140000000000001 110.247 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.12 60.14 0.92 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.518 -0.849 . . . . 61.119999999999997 112.505 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 10.7 m -77.78 99.77 6.02 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.465 -0.568 . . . . 64.129999999999995 109.465 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.9 t -129.9 101.34 5.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.459 -0.337 . . . . 51.229999999999997 110.942 -174.043 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -82.76 132.3 35.18 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.624 -0.51 . . . . 64.420000000000002 109.624 176.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -98.9 122.82 42.65 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.253 0.549 . . . . 72.420000000000002 111.565 -173.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.0 p-80 -133.23 115.44 14.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.374 -0.83 . . . . 75.510000000000005 109.171 175.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 18.8 t-80 -138.28 -15.9 1.25 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.284 -0.416 . . . . 72.430000000000007 110.737 -176.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -76.61 77.07 3.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.184 0.516 . . . . 72.239999999999995 110.314 177.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -93.5 -33.6 13.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.62 -0.718 . . . . 74.439999999999998 109.646 178.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -82.65 114.1 20.79 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.516 -0.766 . . . . 64.019999999999996 110.066 177.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.0 t -140.22 107.65 5.56 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.991 -0.549 . . . . 70.099999999999994 110.482 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 107.2 146.99 13.41 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 111.325 -0.71 . . . . 53.140000000000001 111.325 -176.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.5 ptp85 -143.18 -14.65 0.69 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.141 0.47 . . . . 65.140000000000001 111.931 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 C--N 1.328 -0.366 0 CA-C-O 121.801 0.81 . . . . 75.400000000000006 110.803 -177.543 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.0 mp . . . . . 0 N--CA 1.47 0.526 0 CA-C-O 121.728 0.775 . . . . 64.200000000000003 112.479 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -117.17 155.24 29.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.018 -0.992 . . . . 71.150000000000006 109.442 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.875 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 37.5 tt0 -85.09 121.87 28.49 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.844 -0.799 . . . . 75.219999999999999 108.844 171.039 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 93' ' ' LEU . 10.9 mp -87.42 -66.53 0.9 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.359 -0.382 . . . . 74.329999999999998 111.433 -176.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.542 HD21 HG11 ' A' ' 38' ' ' VAL . 4.0 pp -143.02 160.83 39.63 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.718 -0.393 . . . . 61.520000000000003 111.041 -175.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -144.07 129.18 18.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.513 -0.767 . . . . 74.299999999999997 109.385 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.401 HG21 HD23 ' A' ' 34' ' ' LEU . 11.2 t -151.49 163.46 38.96 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.964 0.411 . . . . 72.439999999999998 110.814 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -110.69 0.59 17.51 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.803 -0.635 . . . . 64.040000000000006 110.758 -177.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -94.43 123.55 37.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.892 0.377 . . . . 75.109999999999999 110.768 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.26 -27.77 63.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 61.200000000000003 111.75 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.28 -50.53 72.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.954 0.407 . . . . 71.319999999999993 110.284 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.401 HD23 HG21 ' A' ' 29' ' ' THR . 55.7 tp -62.4 -40.19 95.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.067 -0.515 . . . . 70.109999999999999 110.47 176.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.509 HD22 ' HD2' ' A' ' 68' ' ' ARG . 76.7 mt -62.15 -31.28 71.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.859 -0.61 . . . . 73.409999999999997 111.351 177.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.0 m -75.6 -44.84 40.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.792 0.33 . . . . 75.219999999999999 110.501 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.482 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -59.94 -50.5 73.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 64.340000000000003 111.055 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.542 HG11 HD21 ' A' ' 27' ' ' LEU . 95.8 t -69.84 -41.93 79.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-O 121.104 0.478 . . . . 65.019999999999996 110.448 178.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.62 -49.13 81.83 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.742 -0.663 . . . . 53.340000000000003 112.793 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.43 -26.41 67.85 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.704 0.261 . . . . 65.549999999999997 111.704 -177.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.561 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.6 mt -69.9 -52.25 26.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.018 0.437 . . . . 73.019999999999996 110.616 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.3 mt -74.5 -39.58 62.35 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.015 -0.538 . . . . 74.540000000000006 111.067 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -68.61 -42.4 78.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.998 -0.546 . . . . 74.129999999999995 110.794 -177.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.96 -29.31 67.18 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 121.12 -0.562 . . . . 51.530000000000001 112.737 -177.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -85.74 -0.75 56.08 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.68 -0.306 . . . . 74.510000000000005 111.184 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.7 t70 66.82 21.23 10.51 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.611 0.72 . . . . 74.349999999999994 110.941 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 63.6 mt -75.84 142.83 13.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.699 -0.682 . . . . 70.129999999999995 109.528 177.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.52 113.44 4.91 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.963 -0.637 . . . . 61.329999999999998 111.832 177.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 33.6 p-80 -128.3 99.3 5.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.328 0.585 . . . . 60.409999999999997 111.532 -173.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.6 tp -83.21 89.0 6.91 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.839 -0.619 . . . . 70.540000000000006 109.373 176.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.658 HG12 HG22 ' A' ' 70' ' ' VAL . 14.9 m . . . . . 0 C--N 1.323 -0.587 0 CA-C-N 115.592 -0.731 . . . . 65.239999999999995 110.502 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo . . . . . 0 N--CA 1.445 -1.378 0 CA-C-O 120.71 0.212 . . . . 60.340000000000003 112.143 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.509 ' HD2' HD22 ' A' ' 35' ' ' LEU . 42.2 ttm180 -74.01 132.66 42.6 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.391 -0.596 . . . . 74.140000000000001 109.391 177.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -113.02 134.49 54.49 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.883 -0.599 . . . . 75.019999999999996 109.514 -174.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.658 HG22 HG12 ' A' ' 51' ' ' VAL . 42.5 t -112.85 118.63 58.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.097 -0.501 . . . . 71.420000000000002 110.8 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.875 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.1 mp -122.71 143.03 50.07 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.136 -0.484 . . . . 74.25 110.058 177.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.51 HG23 HD22 ' A' ' 77' ' ' LEU . 33.0 m -133.56 169.91 20.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.728 -0.215 . . . . 51.420000000000002 110.59 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -74.01 142.19 45.78 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.184 -0.673 . . . . 74.200000000000003 109.184 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.734 ' HA ' HD23 ' A' ' 77' ' ' LEU . 40.3 mt-10 -73.57 -8.46 56.06 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.198 0.814 . . . . 61.240000000000002 113.198 -171.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -86.31 -23.69 26.17 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.204 0.526 . . . . 73.420000000000002 109.77 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -101.18 8.65 42.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.745 -0.661 . . . . 61.039999999999999 110.132 172.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.734 HD23 ' HA ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -59.05 -55.39 35.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.823 -0.626 . . . . 72.439999999999998 110.115 -178.291 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.38 -36.32 71.11 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.129 -0.487 . . . . 64.409999999999997 111.12 177.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.37 -49.14 72.67 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.982 -0.628 . . . . 74.530000000000001 112.007 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.05 -42.94 93.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.502 0.192 . . . . 75.040000000000006 111.108 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.657 ' HD2' HD12 ' A' ' 77' ' ' LEU . 74.8 mtp180 -58.64 -47.25 85.05 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.507 -0.315 . . . . 74.140000000000001 110.412 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -58.72 -47.26 85.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 75.340000000000003 110.304 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.561 HD21 ' HB3' ' A' ' 41' ' ' LEU . 46.8 tp -60.94 -49.61 76.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.729 -0.669 . . . . 75.209999999999994 111.101 -178.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.526 HD21 HG13 ' A' ' 38' ' ' VAL . 84.5 mt -64.93 -36.77 85.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.471 -0.331 . . . . 75.109999999999999 111.351 -178.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 33.2 m -70.99 -41.76 70.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.899 0.38 . . . . 72.310000000000002 110.404 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -65.98 -34.51 78.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.939 -0.573 . . . . 64.540000000000006 110.694 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.54 -34.29 60.73 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.932 -0.576 . . . . 70.319999999999993 111.195 177.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 98.96 28.64 7.66 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.807 -0.711 . . . . 75.049999999999997 111.916 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 97.4 mt -113.79 -1.9 13.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.154 0.502 . . . . 72.420000000000002 110.897 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.569 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -75.0 93.61 2.74 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.547 . . . . 54.340000000000003 110.024 177.072 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -155.13 -44.71 0.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.96 -0.564 . . . . 75.120000000000005 110.346 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -84.27 10.6 10.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.097 -0.501 . . . . 65.5 111.209 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.569 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.3 mp -77.79 101.08 6.55 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.191 -0.459 . . . . 64.200000000000003 109.764 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.445 ' HD2' ' HA ' ' A' ' 94' ' ' ARG . 15.2 tpt180 . . . . . 0 C--N 1.322 -0.614 0 CA-C-N 116.245 -0.434 . . . . 74.209999999999994 110.494 -175.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.9 tpt . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.637 0.256 . . . . 74.239999999999995 110.711 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.2 -6.56 0.15 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.018 -1.087 . . . . 74.450000000000003 113.177 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.1 p -76.39 100.42 5.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.194 0.521 . . . . 63.219999999999999 110.867 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.6 m -152.01 -171.17 3.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.921 -0.581 . . . . 74.540000000000006 109.682 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.6 t60 75.06 -36.0 0.3 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.077 0.551 . . . . 72.340000000000003 111.756 177.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -77.12 86.62 3.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.447 0.641 . . . . 75.540000000000006 109.887 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -135.96 121.95 20.07 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.495 -0.775 . . . . 73.230000000000004 109.202 -177.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -152.29 155.09 37.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.752 -0.203 . . . . 73.129999999999995 110.869 -177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -159.92 106.5 1.62 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.966 0.413 . . . . 73.409999999999997 110.292 176.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.7 t-80 -139.34 80.85 1.8 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.884 -0.598 . . . . 73.319999999999993 109.988 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.7 p -98.68 91.36 5.08 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.006 -0.543 . . . . 62.229999999999997 110.687 -178.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.1 p -132.58 110.89 10.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.046 -0.525 . . . . 63.240000000000002 111.095 -177.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 135.15 131.65 3.08 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.476 -0.869 . . . . 61.009999999999998 112.354 178.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -118.49 -37.38 3.32 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.8 0.333 . . . . 74.129999999999995 110.525 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 121.4 0.619 . . . . 64.230000000000004 110.682 -179.612 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.612 HD22 ' HB2' ' A' ' 50' ' ' LEU . 8.6 mp . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 121.144 0.497 . . . . 72.109999999999999 111.515 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 50.7 mtm180 -110.35 145.39 37.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.288 -0.415 . . . . 70.420000000000002 111.348 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.528 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 32.1 tt0 -70.88 110.96 5.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.651 -0.704 . . . . 70.040000000000006 109.877 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.477 HD22 HG21 ' A' ' 72' ' ' VAL . 57.0 tp -98.85 -38.23 9.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.211 -0.45 . . . . 50.240000000000002 111.348 -174.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.592 ' HG ' ' HB ' ' A' ' 70' ' ' VAL . 1.0 OUTLIER -142.55 148.8 38.16 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.259 0.552 . . . . 74.400000000000006 110.805 179.362 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 28' ' ' ARG . 22.5 ttt180 -138.63 104.61 5.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.334 -0.848 . . . . 71.319999999999993 109.113 -174.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.7 t -121.14 175.84 5.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.43 0.633 . . . . 63.32 112.052 -170.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -130.34 17.54 5.43 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.019 -0.991 . . . . 72.230000000000004 110.58 -175.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -128.34 126.58 41.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 72.310000000000002 111.25 -177.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.674 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -76.95 -26.39 53.95 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.067 -0.515 . . . . 71.299999999999997 111.678 -177.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.9 t -68.71 -45.9 80.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.077 0.465 . . . . 70.340000000000003 109.842 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.15 -38.86 90.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.857 -0.611 . . . . 73.219999999999999 110.303 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.674 HD12 ' HA ' ' A' ' 32' ' ' ALA . 69.1 mt -58.37 -37.7 75.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 74.209999999999994 111.281 176.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.3 m -64.99 -37.05 86.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 51.530000000000001 110.276 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.74 -54.15 8.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.999 -0.546 . . . . 65.409999999999997 111.08 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.574 HG11 HD11 ' A' ' 27' ' ' LEU . 99.5 t -60.58 -38.78 79.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.247 -0.433 . . . . 73.5 111.075 -178.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.66 -51.48 58.44 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.864 -0.607 . . . . 74.340000000000003 112.196 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.23 72.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.644 0.259 . . . . 32.439999999999998 111.355 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 84.1 mt -65.69 -52.14 53.83 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.937 0.399 . . . . 62.020000000000003 110.725 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.4 mt -70.53 -39.1 74.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.919 -0.582 . . . . 74.299999999999997 110.563 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.73 -36.74 81.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 71.010000000000005 110.403 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.85 -24.25 62.51 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 121.047 -0.596 . . . . 64.109999999999999 113.067 -179.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.61 6.82 42.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.927 0.364 . . . . 74.120000000000005 111.464 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.1 t70 67.42 21.2 9.75 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.479 0.657 . . . . 64.420000000000002 110.372 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.818 HG23 ' HB3' ' A' ' 76' ' ' ASP . 78.5 mt -83.14 128.48 38.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.053 -0.521 . . . . 75.129999999999995 110.268 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.32 113.48 5.87 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.104 -0.57 . . . . 71.400000000000006 112.056 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.56 137.54 52.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.117 0.484 . . . . 74.430000000000007 111.431 -177.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.853 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 5.9 tt -107.79 95.17 5.5 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.901 -0.778 . . . . 54.539999999999999 108.901 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.454 HG11 HG22 ' A' ' 70' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 115.582 -0.736 . . . . 64.25 110.176 178.144 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo . . . . . 0 N--CA 1.454 -0.795 0 N-CA-C 110.251 -0.711 . . . . 65.400000000000006 110.251 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.471 ' HA ' ' NE ' ' A' ' 68' ' ' ARG . 5.3 mmp_? -127.57 150.83 49.54 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.46 0.648 . . . . 75.530000000000001 111.417 -175.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.492 ' HD3' ' OE1' ' A' ' 25' ' ' GLU . 18.9 ptp180 -114.72 136.85 52.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.832 -1.076 . . . . 74.329999999999998 108.948 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.592 ' HB ' ' HG ' ' A' ' 27' ' ' LEU . 97.8 t -108.52 114.4 46.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 120.953 0.406 . . . . 71.109999999999999 110.272 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.853 ' HB2' ' HB3' ' A' ' 50' ' ' LEU . 8.5 mp -101.53 140.12 36.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.573 -0.74 . . . . 71.430000000000007 109.4 176.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.864 HG23 HD22 ' A' ' 77' ' ' LEU . 23.9 m -126.16 162.94 28.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.325 0.583 . . . . 71.319999999999993 111.13 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.463 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 2.5 t-160 -74.22 162.19 29.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.079 -0.964 . . . . 70.340000000000003 110.257 -175.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.588 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 26.0 mm-40 -58.09 -58.88 6.49 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.85 0.685 . . . . 71.329999999999998 112.85 -174.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -73.33 -25.31 60.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.557 0.694 . . . . 64.239999999999995 110.041 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.818 ' HB3' HG23 ' A' ' 47' ' ' ILE . 1.5 m-20 -74.24 -14.65 60.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.168 -0.923 . . . . 63.539999999999999 110.63 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.864 HD22 HG23 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -53.49 -57.79 9.44 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.01 0.524 . . . . 71.040000000000006 111.249 -177.338 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.8 -38.34 90.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.691 -0.686 . . . . 70.129999999999995 111.04 -178.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.52 -44.99 94.37 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.902 -0.666 . . . . 74.420000000000002 112.124 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.58 97.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.728 0.299 . . . . 74.319999999999993 110.714 179.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -60.88 -50.94 71.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.43 . . . . 63.32 110.59 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -57.67 -43.95 85.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 64.510000000000005 110.819 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.6 tp -59.84 -54.74 42.67 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.028 -0.533 . . . . 72.030000000000001 111.054 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.479 HD21 HG13 ' A' ' 38' ' ' VAL . 90.4 mt -63.18 -30.78 71.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.996 -0.547 . . . . 75.310000000000002 111.385 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 88.4 m -66.79 -43.0 85.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.573 0.225 . . . . 72.349999999999994 110.812 178.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -69.09 -34.11 74.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.978 0.418 . . . . 60.509999999999998 110.582 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.95 -4.26 54.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.904 -0.589 . . . . 73.109999999999999 111.673 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 72.32 21.67 79.24 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.99 -0.624 . . . . 72.030000000000001 112.785 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.0 mt -105.47 10.26 33.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.08 0.467 . . . . 73.209999999999994 110.829 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.724 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -73.78 77.09 1.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.45 -0.574 . . . . 61.530000000000001 109.45 174.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -131.56 -51.22 0.99 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.332 -0.849 . . . . 71.329999999999998 110.421 -172.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -91.74 8.83 35.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.598 -0.728 . . . . 75.420000000000002 110.974 -176.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.724 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.3 mp -73.47 134.37 43.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.168 -0.469 . . . . 73.5 110.319 -178.606 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 53.3 mtt180 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.064 -0.516 . . . . 72.109999999999999 110.8 -177.263 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 110.045 -0.354 . . . . 61.149999999999999 110.045 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 102.24 126.66 5.9 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.599 -0.81 . . . . 61.43 112.951 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.4 t -130.94 125.47 33.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.648 -0.871 . . . . 70.219999999999999 108.648 173.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.3 m -139.78 117.96 11.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.112 0.482 . . . . 30.23 111.658 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -162.7 96.01 0.92 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.614 -0.721 . . . . 75.430000000000007 109.748 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -140.3 92.16 2.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.831 0.824 . . . . 52.030000000000001 111.194 178.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -131.68 85.75 2.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.743 -0.662 . . . . 74.430000000000007 109.825 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.3 t-80 -160.2 84.04 0.72 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.787 -0.642 . . . . 71.540000000000006 110.457 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -157.46 42.65 0.32 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.45 -0.574 . . . . 74.010000000000005 109.45 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 35.9 t-80 -83.98 86.92 7.12 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.975 -0.75 . . . . 74.010000000000005 108.975 176.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.6 m -155.07 102.66 2.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.695 -0.684 . . . . 63.109999999999999 109.92 -175.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -149.65 114.42 5.33 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.374 -0.376 . . . . 60.450000000000003 110.399 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -107.86 169.66 14.69 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.733 -0.746 . . . . 62.219999999999999 111.795 178.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -115.71 102.78 10.05 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.063 0.459 . . . . 71.439999999999998 110.792 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 C--N 1.325 -0.473 0 CA-C-O 121.035 0.445 . . . . 73.019999999999996 110.071 177.151 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 N--CA 1.463 0.219 0 CA-C-O 121.316 0.579 . . . . 74.049999999999997 110.027 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.498 ' HB2' HD23 ' A' ' 77' ' ' LEU . 87.7 mtt180 -107.11 147.78 29.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.082 -0.508 . . . . 73.409999999999997 110.189 -174.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.621 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 35.7 tt0 -72.83 136.67 45.41 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.529 -0.545 . . . . 63.420000000000002 109.529 177.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.639 HD12 HD22 ' A' ' 27' ' ' LEU . 1.4 tm? -97.75 -50.45 4.45 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.716 -0.476 . . . . 61.549999999999997 109.716 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.639 HD22 HD12 ' A' ' 26' ' ' LEU . 2.6 pt? -158.39 157.98 33.35 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.472 -0.331 . . . . 75.099999999999994 110.805 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.19 132.03 42.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.834 -0.621 . . . . 63.32 110.16 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.4 t -142.99 170.96 14.72 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.917 -0.401 . . . . 74.299999999999997 109.917 176.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.638 ' HA ' ' HA ' ' A' ' 67' ' ' PRO . 4.2 p-10 -116.67 9.63 14.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.347 0.594 . . . . 64.329999999999998 110.008 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -117.09 128.37 55.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.539 -0.755 . . . . 71.349999999999994 111.266 -175.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.703 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -77.54 -21.07 53.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.819 -0.628 . . . . 54.409999999999997 111.705 -176.337 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.7 t -69.18 -49.39 62.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.156 0.503 . . . . 65.040000000000006 109.849 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.5 tp -60.91 -37.51 82.52 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.641 -0.709 . . . . 63.340000000000003 110.231 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.703 HD12 ' HA ' ' A' ' 32' ' ' ALA . 78.5 mt -59.34 -35.15 73.32 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.98 -0.555 . . . . 61.299999999999997 111.072 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -69.74 -42.54 73.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.4 -0.364 . . . . 71.209999999999994 110.445 179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.498 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.77 -53.17 44.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 63.439999999999998 111.04 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.525 HG13 HD21 ' A' ' 84' ' ' LEU . 99.1 t -61.43 -40.57 86.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 121.127 0.489 . . . . 74.230000000000004 110.591 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.4 -48.48 85.97 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.685 -0.689 . . . . 73.209999999999994 111.979 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.63 -28.48 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 62.439999999999998 111.443 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 88.3 mt -67.13 -51.64 51.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.863 0.364 . . . . 72.049999999999997 110.559 177.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 82.5 mt -72.43 -39.11 68.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.98 -0.555 . . . . 75.120000000000005 110.665 -177.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -66.92 -41.2 87.45 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.463 -0.79 . . . . 73.230000000000004 110.666 -178.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -80.08 -11.79 84.03 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.622 -0.799 . . . . 62.549999999999997 112.83 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -102.85 4.22 37.5 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.711 -0.288 . . . . 61.240000000000002 111.225 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.4 t70 63.15 32.48 15.11 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.682 0.753 . . . . 71.530000000000001 110.575 178.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 68.6 mt -93.58 130.09 43.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.884 -0.598 . . . . 63.119999999999997 110.308 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.18 117.96 6.59 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.929 -0.578 . . . . 62.32 112.165 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 54.0 p-80 -139.53 142.53 37.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.078 0.466 . . . . 44.340000000000003 110.935 -175.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 tp -113.31 115.82 28.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.971 -0.558 . . . . 73.230000000000004 110.824 -176.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.7 m . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.582 -0.736 . . . . 73.420000000000002 109.753 173.792 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.638 ' HA ' ' HA ' ' A' ' 30' ' ' ASN . 10.4 Cg_exo . . . . . 0 N--CA 1.46 -0.481 0 CA-C-O 121.005 0.335 . . . . 74.5 111.231 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.636 ' HB3' HD11 ' A' ' 35' ' ' LEU . 12.7 tpp180 -93.99 135.47 35.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.513 0.673 . . . . 75.310000000000002 110.952 -175.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.478 ' HD2' ' OE1' ' A' ' 25' ' ' GLU . 18.1 ptt180 -119.01 145.97 45.42 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.414 -0.812 . . . . 62.210000000000001 110.122 178.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.2 t -105.18 123.3 59.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.859 -0.609 . . . . 61.229999999999997 110.101 -177.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.621 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 9.6 mp -103.88 155.34 18.7 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.402 -0.592 . . . . 75.140000000000001 109.402 175.4 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.4 m -137.82 168.49 20.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.773 0.32 . . . . 62.130000000000003 110.399 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.424 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 27.6 m80 -73.42 160.51 31.65 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.95 -0.759 . . . . 73.519999999999996 108.95 176.18 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.32 -11.07 60.54 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.983 0.421 . . . . 72.409999999999997 110.849 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -91.71 -23.18 19.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.031 -0.532 . . . . 75.310000000000002 110.729 174.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.424 ' OD1' ' HB2' ' A' ' 73' ' ' HIS . 9.8 m-20 -93.76 -13.31 27.54 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.873 -0.603 . . . . 73.319999999999993 110.213 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.498 HD23 ' HB2' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -52.74 -57.08 11.29 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.639 -0.71 . . . . 74.420000000000002 111.183 -176.462 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.85 97.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.383 -0.371 . . . . 71.109999999999999 111.322 -177.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.8 -46.67 81.41 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.816 -0.706 . . . . 71.120000000000005 112.446 -177.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.51 -41.21 96.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.653 0.263 . . . . 73.310000000000002 111.413 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -60.47 -53.02 62.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.338 -0.392 . . . . 73.439999999999998 111.241 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -64.34 -32.62 74.3 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.704 0.261 . . . . 63.100000000000001 111.704 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.59 -54.65 32.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.783 0.325 . . . . 71.200000000000003 110.707 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.525 HD21 HG13 ' A' ' 38' ' ' VAL . 11.3 mp -65.46 -31.71 72.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 73.540000000000006 111.442 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.727 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 85.7 m -64.31 -46.28 84.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.739 0.304 . . . . 44.399999999999999 110.782 178.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.73 -29.79 69.11 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.036 0.446 . . . . 71.019999999999996 110.457 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.3 -14.79 60.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.183 -0.462 . . . . 74.230000000000004 111.131 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.64 9.57 66.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.798 -0.715 . . . . 73.099999999999994 112.415 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 79.9 mt -96.88 14.29 25.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.917 0.389 . . . . 71.549999999999997 110.727 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.788 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -71.57 80.6 0.81 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.035 -0.529 . . . . 52.119999999999997 110.668 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -134.96 -58.12 0.81 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.939 -0.573 . . . . 64.329999999999998 109.883 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' A' ' 94' ' ' ARG . 77.0 mm-40 -90.67 7.84 37.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.221 -0.445 . . . . 74.299999999999997 111.751 -178.261 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.788 HD13 ' HA ' ' A' ' 90' ' ' ALA . 10.8 mp -61.29 118.94 7.55 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.811 -0.44 . . . . 71.129999999999995 109.811 176.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.535 ' HG3' ' O ' ' A' ' 92' ' ' GLU . 58.0 mtt180 . . . . . 0 C--N 1.322 -0.596 0 CA-C-O 121.566 0.698 . . . . 75.329999999999998 112.417 -172.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.479 1.024 0 CA-C-O 120.883 0.373 . . . . 64.310000000000002 110.416 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.02 130.16 5.36 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.868 -0.682 . . . . 63.310000000000002 111.879 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.0 p -121.69 -171.81 2.3 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.937 -0.394 . . . . 73.319999999999993 109.937 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.7 t -143.02 130.81 21.48 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.877 -0.416 . . . . 60.439999999999998 109.877 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -75.86 140.29 42.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.274 -0.421 . . . . 74.120000000000005 110.058 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -88.34 124.01 33.49 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.922 0.392 . . . . 73.329999999999998 111.275 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -146.55 166.3 26.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 74.129999999999995 110.355 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.1 p-80 -170.45 152.59 4.02 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.372 -0.603 . . . . 71.340000000000003 109.372 175.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -151.09 126.7 10.17 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.205 0.526 . . . . 73.019999999999996 111.801 -178.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -135.02 136.39 42.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.677 -0.692 . . . . 73.439999999999998 109.538 172.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.8 m -126.9 107.21 9.89 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.848 0.356 . . . . 73.230000000000004 110.579 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.0 m -110.66 112.3 24.09 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.153 -0.476 . . . . 73.299999999999997 110.531 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 155.63 142.43 3.43 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.506 -0.854 . . . . 74.510000000000005 112.816 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 14' ' ' ARG . 37.3 ttm180 -129.53 134.33 47.71 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.661 -0.496 . . . . 75.120000000000005 109.661 175.354 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 . . . . . 0 C--N 1.324 -0.506 0 CA-C-O 121.048 0.451 . . . . 75.430000000000007 110.922 -179.768 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.623 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . 6.0 mp . . . . . 0 C--O 1.231 0.125 0 N-CA-C 109.709 -0.478 . . . . 75.019999999999996 109.709 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.415 ' HG2' ' HG2' ' A' ' 74' ' ' GLU . 22.9 mmt180 -123.98 155.03 38.96 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.889 -0.411 . . . . 71.030000000000001 109.889 -178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -62.67 111.29 2.02 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 121.201 0.524 . . . . 73.099999999999994 110.813 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.6 tp -80.99 -23.03 39.01 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.166 -0.925 . . . . 72.109999999999999 108.809 175.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.506 ' HA ' ' HA ' ' A' ' 94' ' ' ARG . 0.7 OUTLIER 179.18 162.17 0.8 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.011 -0.995 . . . . 64.010000000000005 109.524 176.898 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -149.19 147.53 28.54 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.467 -0.568 . . . . 72.129999999999995 109.467 -179.294 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.411 HG22 HD21 ' A' ' 35' ' ' LEU . 13.4 t -170.1 169.36 7.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.979 0.419 . . . . 61.399999999999999 110.56 178.482 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -97.08 -8.8 29.38 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.909 -0.587 . . . . 74.450000000000003 110.678 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -82.28 148.54 28.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.375 -0.375 . . . . 74.329999999999998 110.625 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.63 -9.8 14.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.52 -0.309 . . . . 60.329999999999998 111.514 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.1 t -79.05 -43.53 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.289 0.566 . . . . 74.420000000000002 111.012 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.606 HD21 HD13 ' A' ' 89' ' ' LEU . 39.5 tp -70.1 -41.05 74.52 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.805 -0.634 . . . . 50.140000000000001 110.741 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.453 ' CD1' ' HB3' ' A' ' 68' ' ' ARG . 68.2 mt -64.87 -36.2 83.57 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.126 0.417 . . . . 73.329999999999998 112.126 -174.089 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.0 p -66.76 -29.7 69.73 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.99 0.424 . . . . 63.439999999999998 110.575 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.4 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.38 -42.95 61.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.452 . . . . 74.349999999999994 110.108 176.586 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 34' ' ' LEU . 61.6 t -57.3 -41.97 79.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.716 -0.675 . . . . 74.329999999999998 110.408 176.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -56.61 -50.59 62.12 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.41 -0.814 . . . . 74.430000000000007 112.305 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.94 -34.29 71.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.74 0.305 . . . . 73.0 111.406 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 83.5 mt -67.19 -46.46 73.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.111 0.482 . . . . 72.439999999999998 110.174 178.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.9 mt -69.12 -31.69 70.55 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.879 -0.601 . . . . 72.209999999999994 111.162 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -71.07 -38.72 72.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.266 -0.425 . . . . 61.009999999999998 110.081 175.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.01 -43.01 94.37 Favored Glycine 0 C--N 1.332 0.338 0 CA-C-N 115.956 -0.566 . . . . 50.329999999999998 112.452 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.4 -10.18 59.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.874 0.369 . . . . 72.409999999999997 110.66 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t70 61.92 34.65 16.75 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.386 -0.824 . . . . 73.340000000000003 110.906 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.2 mt -85.13 -29.35 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.724 0.773 . . . . 55.43 109.568 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.6 169.65 37.17 Favored Glycine 0 N--CA 1.447 -0.613 0 CA-C-N 114.987 -1.006 . . . . 44.100000000000001 111.595 -177.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -160.93 137.78 8.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.961 0.41 . . . . 52.25 111.954 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 2.8 tm? -109.75 103.25 12.05 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 107.755 -1.202 . . . . 51.520000000000003 107.755 168.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.597 HG12 HG22 ' A' ' 70' ' ' VAL . 3.1 m . . . . . 0 C--N 1.323 -0.551 0 CA-C-O 121.516 0.674 . . . . 63.25 111.493 -174.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo . . . . . 0 N--CA 1.447 -1.23 0 CA-C-O 121.012 0.338 . . . . 71.099999999999994 111.536 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.453 ' HB3' ' CD1' ' A' ' 35' ' ' LEU . 55.8 ttm-85 -89.32 136.31 33.09 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.908 -0.404 . . . . 73.239999999999995 109.908 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.99 141.94 46.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.239 -0.437 . . . . 51.439999999999998 110.362 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.597 HG22 HG12 ' A' ' 51' ' ' VAL . 48.1 t -102.38 106.94 20.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.663 -0.699 . . . . 74.510000000000005 109.838 177.566 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.623 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 10.3 mp -106.12 132.86 51.69 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.901 0.382 . . . . 62.350000000000001 111.103 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.3 m -120.77 155.25 24.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.307 -0.627 . . . . 65.030000000000001 109.307 173.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.434 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 7.5 t-80 -64.37 144.79 56.91 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.893 -0.41 . . . . 61.100000000000001 109.893 -178.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.528 ' HA ' HD23 ' A' ' 77' ' ' LEU . 42.6 mt-10 -71.6 69.23 0.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.299 0.571 . . . . 72.25 111.864 -176.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -141.98 -51.53 0.41 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.2 -0.909 . . . . 70.019999999999996 109.477 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -108.88 43.73 1.22 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.425 -0.807 . . . . 74.25 111.733 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 74' ' ' GLU . 4.1 mm? -65.18 -52.89 52.13 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.712 -0.477 . . . . 61.009999999999998 109.712 175.439 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.9 -22.64 62.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.203 -0.453 . . . . 73.239999999999995 110.942 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.24 -48.05 15.92 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 121.04 -0.6 . . . . 75.120000000000005 112.017 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.04 -38.62 86.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.776 0.322 . . . . 60.109999999999999 110.467 177.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.45 HH11 ' HD2' ' A' ' 81' ' ' ARG . 21.0 mtp180 -62.1 -28.23 69.47 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.119 -0.491 . . . . 71.450000000000003 110.406 175.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -69.8 -51.1 36.69 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.497 -0.557 . . . . 73.409999999999997 109.497 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.3 tp -60.01 -51.65 68.75 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.113 -0.949 . . . . 62.509999999999998 111.631 -177.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.0 mp -63.05 -27.58 69.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 73.329999999999998 111.844 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.889 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 70.1 m -81.45 -43.24 19.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.824 0.345 . . . . 73.340000000000003 111.08 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.69 -44.14 78.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 71.310000000000002 110.881 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.09 87.86 1.22 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.227 -0.442 . . . . 73.150000000000006 110.717 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -172.47 -69.43 0.04 OUTLIER Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.447 -0.883 . . . . 33.530000000000001 111.987 176.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.692 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -164.12 -56.65 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.637 0.256 . . . . 74.400000000000006 110.937 -175.966 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.889 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 60.6 13.37 4.19 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.72 -0.673 . . . . 71.340000000000003 112.168 -177.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -87.23 -40.99 14.04 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.131 -0.227 . . . . 72.140000000000001 110.992 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -93.5 -81.61 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.997 -0.281 . . . . 72.349999999999994 111.228 -177.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 96.1 mt 53.48 43.59 31.08 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.743 0.782 . . . . 71.310000000000002 109.521 -172.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.506 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 49.6 ttt180 . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 113.693 -1.594 . . . . 62.0 111.048 -173.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.736 0.303 . . . . 73.150000000000006 110.326 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.12 100.41 0.29 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.784 -0.722 . . . . 70.209999999999994 112.542 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.7 t -84.8 127.68 34.25 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.312 -0.625 . . . . 73.420000000000002 109.312 177.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.6 p -120.33 101.09 7.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.203 0.525 . . . . 54.439999999999998 111.061 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -158.81 118.91 3.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.702 -0.681 . . . . 44.119999999999997 110.617 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -149.98 115.86 5.62 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.537 -0.912 . . . . 62.439999999999998 108.537 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -93.41 106.21 18.2 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.389 -0.369 . . . . 70.239999999999995 110.689 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 24.1 p-80 -104.57 113.63 27.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.421 0.629 . . . . 70.409999999999997 110.936 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -149.37 108.03 3.83 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.592 -0.731 . . . . 73.519999999999996 109.918 174.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -160.72 125.9 3.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.135 -0.484 . . . . 63.140000000000001 110.515 -177.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.4 p -155.27 86.41 1.09 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.026 -0.533 . . . . 72.239999999999995 110.281 177.343 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.5 m -152.46 124.81 8.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.169 -0.469 . . . . 74.519999999999996 110.79 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 140.56 97.33 0.32 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.966 -0.635 . . . . 61.140000000000001 112.285 176.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.7 ttp180 -106.73 -41.1 5.32 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.496 -0.557 . . . . 71.040000000000006 109.496 177.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 . . . . . 0 C--O 1.236 0.39 0 CA-C-N 115.364 -0.835 . . . . 62.520000000000003 111.908 175.006 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.7 mp . . . . . 0 N--CA 1.468 0.468 0 CA-C-O 121.547 0.689 . . . . 75.219999999999999 111.783 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -125.36 166.04 17.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.459 -0.791 . . . . 71.519999999999996 109.162 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.803 ' HG2' ' HD2' ' A' ' 69' ' ' ARG . 2.0 mp0 -77.92 124.25 27.77 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.284 -0.635 . . . . 64.340000000000003 109.284 171.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.521 ' HB3' HD23 ' A' ' 27' ' ' LEU . 1.1 tm? -77.17 -30.73 55.03 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 108.801 -0.814 . . . . 74.5 108.801 177.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.521 HD23 ' HB3' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -170.08 160.53 8.17 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.563 -0.744 . . . . 73.230000000000004 110.84 -175.197 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.513 ' HD3' ' HB3' ' A' ' 67' ' ' PRO . 6.0 tmm_? -127.56 106.48 9.2 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 107.0 -1.481 . . . . 74.439999999999998 107.0 170.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.5 HG21 HD21 ' A' ' 35' ' ' LEU . 14.6 t -78.25 164.2 25.1 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.482 0.658 . . . . 72.230000000000004 111.573 -166.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -114.7 -3.5 12.84 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.159 -0.928 . . . . 55.5 110.397 178.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -131.93 147.2 52.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.504 -0.316 . . . . 44.450000000000003 110.995 -175.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -93.74 -23.35 18.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.346 -0.388 . . . . 63.229999999999997 111.532 -175.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.0 t -79.18 -37.78 19.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.319 0.58 . . . . 71.099999999999994 110.0 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.3 tp -57.03 -32.25 65.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.413 -0.812 . . . . 72.099999999999994 111.284 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.5 HD21 HG21 ' A' ' 29' ' ' THR . 93.5 mt -56.08 -39.6 72.34 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.944 0.402 . . . . 74.409999999999997 111.446 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.4 m -64.95 -26.85 68.48 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.886 -0.597 . . . . 51.409999999999997 110.895 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.21 -47.9 10.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.267 -0.424 . . . . 55.229999999999997 110.639 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.429 ' HA ' HD12 ' A' ' 41' ' ' LEU . 86.4 t -58.58 -40.54 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.163 -0.472 . . . . 73.310000000000002 111.416 -179.338 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.03 -50.03 72.09 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.025 -0.607 . . . . 73.099999999999994 112.553 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.41 -27.22 69.15 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.895 0.378 . . . . 71.209999999999994 111.295 -177.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.443 ' HB3' HD21 ' A' ' 83' ' ' LEU . 91.9 mt -69.82 -51.66 31.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.966 -0.561 . . . . 75.25 110.168 177.17 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.4 mt -65.44 -40.21 93.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.669 -0.696 . . . . 45.310000000000002 110.919 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -64.63 -47.56 78.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.993 0.425 . . . . 72.340000000000003 110.662 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.09 -25.75 75.18 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.984 -0.627 . . . . 44.340000000000003 113.058 -176.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.74 1.63 56.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.681 0.241 . . . . 51.240000000000002 111.46 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.2 t70 64.86 33.19 10.28 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 122.001 0.905 . . . . 71.25 110.287 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.803 HG23 ' HB3' ' A' ' 76' ' ' ASP . 71.5 mt -88.25 128.27 40.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.353 -0.839 . . . . 73.040000000000006 110.394 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.69 99.16 0.9 Allowed Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.812 -0.515 . . . . 44.109999999999999 111.812 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -122.7 152.52 40.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.778 0.323 . . . . 70.010000000000005 110.887 -173.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.0 tp -129.03 104.8 7.78 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.873 -0.603 . . . . 43.43 110.159 177.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.3 m . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 116.095 -0.502 . . . . 65.450000000000003 110.708 177.081 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PRO . . . . . 0.513 ' HB3' ' HD3' ' A' ' 28' ' ' ARG . 22.3 Cg_exo . . . . . 0 N--CA 1.463 -0.301 0 CA-C-O 121.052 0.355 . . . . 72.340000000000003 111.308 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.534 ' HA ' ' CZ ' ' A' ' 68' ' ' ARG . 0.7 OUTLIER -97.35 138.11 35.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.219 -0.446 . . . . 74.230000000000004 110.723 -177.305 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.803 ' HD2' ' HG2' ' A' ' 25' ' ' GLU . 81.9 mtm180 -113.55 133.54 55.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.994 -0.548 . . . . 71.109999999999999 109.865 178.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.2 t -103.62 114.93 44.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.518 -0.549 . . . . 73.310000000000002 109.518 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.481 HD11 ' HG3' ' A' ' 25' ' ' GLU . 10.1 mp -103.59 144.18 31.77 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.851 0.358 . . . . 72.200000000000003 111.143 -177.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.504 HG23 HD22 ' A' ' 77' ' ' LEU . 26.2 m -141.5 167.27 16.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.682 -0.69 . . . . 75.450000000000003 109.811 176.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.505 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 14.1 m-70 -74.8 162.87 28.28 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.21 -0.663 . . . . 74.340000000000003 109.21 176.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.514 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 17.5 mt-10 -71.17 -18.62 62.48 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.214 -0.662 . . . . 74.409999999999997 109.214 174.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -66.87 -37.79 85.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.266 -0.879 . . . . 72.230000000000004 109.624 172.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.803 ' HB3' HG23 ' A' ' 47' ' ' ILE . 8.5 m-20 -97.45 -4.86 37.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.057 -0.974 . . . . 61.310000000000002 110.505 -175.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.612 ' O ' ' HG3' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -53.24 -58.26 7.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.837 -0.62 . . . . 73.219999999999999 111.233 -172.1 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.84 -32.72 72.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.801 0.334 . . . . 54.109999999999999 111.232 -177.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.76 -47.17 91.17 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.81 -0.709 . . . . 62.43 112.055 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.58 -40.8 80.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.504 0.193 . . . . 55.210000000000001 110.837 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.612 ' HG3' ' O ' ' A' ' 77' ' ' LEU . 21.0 mtp180 -57.36 -53.88 53.13 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.416 -0.357 . . . . 74.439999999999998 110.969 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -67.24 -37.55 83.71 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.833 -0.347 . . . . 64.019999999999996 110.864 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.443 HD21 ' HB3' ' A' ' 41' ' ' LEU . 60.6 tp -58.89 -54.94 41.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.072 0.463 . . . . 64.310000000000002 110.773 179.088 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.9 mt -66.09 -27.62 68.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.794 -0.639 . . . . 71.340000000000003 111.724 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.75 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 69.0 m -79.37 -42.7 24.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.768 0.318 . . . . 42.43 111.0 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.96 -43.91 70.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.997 -0.547 . . . . 60.030000000000001 112.261 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.49 23.72 4.39 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.397 0.517 . . . . 43.210000000000001 112.397 -175.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -121.01 -84.01 0.76 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.03 -1.081 . . . . 73.5 111.517 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.524 HD12 ' N ' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -178.35 -31.84 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.48 -0.36 . . . . 70.120000000000005 111.514 -175.832 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.75 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 59.36 24.58 13.16 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.818 0.342 . . . . 72.510000000000005 111.686 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' HIS . . . . . 0.458 ' H ' ' CD1' ' A' ' 89' ' ' LEU . 59.1 t-80 -89.98 -22.76 21.76 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.337 -0.392 . . . . 71.129999999999995 111.164 -175.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -92.69 -8.32 44.3 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.291 -0.413 . . . . 43.130000000000003 111.686 -173.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.692 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.5 mp -70.42 94.59 0.97 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.148 0.499 . . . . 73.040000000000006 110.696 -176.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 115.757 -0.656 . . . . 74.430000000000007 111.739 -174.686 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 mmt . . . . . 0 N--CA 1.482 1.139 0 CA-C-O 120.695 0.284 . . . . 52.329999999999998 110.263 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 118.91 112.81 2.49 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.882 -0.675 . . . . 71.049999999999997 112.128 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.7 t -128.96 95.74 4.16 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.981 0.42 . . . . 72.129999999999995 109.951 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.0 m -147.84 147.9 30.29 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.653 -0.703 . . . . 73.400000000000006 109.669 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -137.37 105.68 5.76 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.297 0.57 . . . . 73.409999999999997 110.698 178.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -102.62 119.59 39.09 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.781 -0.645 . . . . 74.519999999999996 109.868 177.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -71.9 87.84 1.02 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.21 -0.45 . . . . 70.400000000000006 110.064 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -75.99 150.3 37.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.065 -0.516 . . . . 73.319999999999993 110.851 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -171.2 101.83 0.21 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.127 -0.488 . . . . 71.409999999999997 110.182 176.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -100.03 152.55 20.08 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.184 -0.462 . . . . 65.120000000000005 110.034 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.2 p -84.87 164.63 18.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.348 -0.387 . . . . 75.129999999999995 110.792 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.3 m -114.22 121.18 42.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.918 0.39 . . . . 62.109999999999999 110.505 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -170.56 103.41 0.19 Allowed Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.294 -0.722 . . . . 44.109999999999999 111.294 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.8 ptt180 -119.17 141.64 48.67 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.933 0.397 . . . . 74.329999999999998 110.919 -176.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.636 0 CA-C-N 115.784 -0.644 . . . . 75.109999999999999 109.594 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 121.028 0.442 . . . . 51.329999999999998 110.508 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.7 ' HB3' HD23 ' A' ' 77' ' ' LEU . 0.6 OUTLIER -143.84 127.19 16.77 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.766 -0.457 . . . . 74.319999999999993 109.766 -178.63 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.728 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 24.8 tt0 -68.38 117.87 10.72 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.096 -0.502 . . . . 74.540000000000006 109.646 178.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.729 HD12 HD23 ' A' ' 27' ' ' LEU . 2.7 tm? -93.64 -61.18 1.6 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.233 -0.44 . . . . 74.219999999999999 111.292 -171.172 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.729 HD23 HD12 ' A' ' 26' ' ' LEU . 2.6 pp -142.25 161.7 37.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.779 0.323 . . . . 62.219999999999999 111.063 -173.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -134.94 135.87 41.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.686 -0.688 . . . . 70.329999999999998 110.038 178.983 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.4 t -144.61 176.41 9.43 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.019 0.438 . . . . 62.219999999999999 110.943 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -117.72 -11.31 10.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.982 -0.553 . . . . 75.329999999999998 110.103 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -102.61 153.96 19.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.753 -0.658 . . . . 72.140000000000001 110.768 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -111.59 -11.28 14.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.252 -0.431 . . . . 54.240000000000002 111.239 -178.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.9 t -78.52 -43.93 26.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.918 0.39 . . . . 73.140000000000001 110.482 -178.218 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.663 HD21 HD13 ' A' ' 89' ' ' LEU . 66.1 tp -60.32 -31.6 70.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.891 -0.595 . . . . 73.120000000000005 110.797 177.568 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 77.6 mt -62.4 -22.64 66.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.583 -0.735 . . . . 70.400000000000006 111.754 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.3 m -60.83 -45.03 96.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.846 0.355 . . . . 53.140000000000001 110.362 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.518 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -68.06 -41.61 81.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.289 -0.414 . . . . 72.299999999999997 110.616 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 56.8 t -60.02 -45.35 95.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.94 -0.573 . . . . 73.230000000000004 110.27 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.44 -44.62 96.47 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.602 -0.726 . . . . 63.140000000000001 112.151 -179.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.36 -33.62 72.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.852 0.358 . . . . 51.509999999999998 110.986 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 91.2 mt -72.09 -47.77 48.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.13 -0.486 . . . . 62.140000000000001 110.7 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 91.4 mt -65.72 -47.42 75.39 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.113 -0.494 . . . . 60.43 110.809 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -42.27 98.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 74.319999999999993 110.836 178.172 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.32 -35.56 87.95 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.231 -0.509 . . . . 71.450000000000003 112.868 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.84 -0.01 55.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.619 0.247 . . . . 72.519999999999996 111.095 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.5 t70 61.38 35.76 17.74 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.999 0.904 . . . . 65.439999999999998 110.232 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.672 HG23 ' HB3' ' A' ' 76' ' ' ASP . 64.9 mt -88.8 119.73 36.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.156 -0.929 . . . . 74.030000000000001 110.57 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.82 137.0 46.98 Favored Glycine 0 C--N 1.332 0.307 0 N-CA-C 111.528 -0.629 . . . . 61.229999999999997 111.528 175.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 38.9 p-80 -152.56 138.57 18.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.114 0.483 . . . . 73.540000000000006 111.68 -171.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.0 tt -126.87 103.93 7.77 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.503 -0.771 . . . . 34.549999999999997 109.163 177.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 C--N 1.324 -0.508 0 N-CA-C 109.85 -0.426 . . . . 63.140000000000001 109.85 177.877 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo . . . . . 0 N--CA 1.463 -0.269 0 CA-C-O 120.859 0.275 . . . . 73.450000000000003 112.0 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 29.0 mmt-85 -101.84 113.33 26.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.192 -0.458 . . . . 75.519999999999996 109.838 -178.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -124.93 142.31 51.55 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.223 -0.591 . . . . 71.439999999999998 110.934 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.8 t -108.85 125.35 65.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.593 -0.73 . . . . 55.119999999999997 110.756 -174.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.728 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.0 mp -106.23 142.76 35.39 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.546 -0.538 . . . . 72.030000000000001 109.546 174.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.8 m -132.12 -178.41 2.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 109.847 -0.427 . . . . 55.149999999999999 109.847 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.587 ' HB2' ' HB2' ' A' ' 76' ' ' ASP . 24.9 m170 -68.49 158.12 34.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.817 0.341 . . . . 73.510000000000005 110.724 177.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -67.63 -38.78 84.39 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.221 -0.659 . . . . 73.030000000000001 109.221 174.482 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -73.4 -39.93 64.7 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.972 -1.013 . . . . 73.120000000000005 110.855 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.672 ' HB3' HG23 ' A' ' 47' ' ' ILE . 9.7 m-20 -78.34 -8.91 58.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.8 -0.636 . . . . 44.409999999999997 111.132 -178.391 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.757 HD12 ' HD3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -54.51 -46.2 73.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.041 0.448 . . . . 63.310000000000002 109.864 179.328 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.59 -36.64 79.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.506 -0.77 . . . . 63.119999999999997 111.357 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -78.49 -46.51 8.79 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.365 -0.921 . . . . 72.340000000000003 112.157 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.96 -47.9 73.08 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.911 0.337 . . . . 71.530000000000001 111.911 -175.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.757 ' HD3' HD12 ' A' ' 77' ' ' LEU . 15.5 ptt180 -68.56 -22.39 64.49 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.6 -0.44 . . . . 72.450000000000003 110.674 -176.54 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.4 ttp85 -78.2 -48.72 15.22 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.935 -0.395 . . . . 74.530000000000001 109.935 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 41.4 tp -59.56 -50.36 74.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.602 -0.726 . . . . 52.420000000000002 111.355 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.99 -27.87 68.47 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.929 -0.578 . . . . 73.25 111.917 -177.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.983 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 98.7 m -82.37 -37.35 25.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.791 0.329 . . . . 72.109999999999999 111.277 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -74.42 -44.69 50.73 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.944 0.349 . . . . 50.350000000000001 111.944 -176.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -142.95 35.65 1.39 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 111.851 0.315 . . . . 54.420000000000002 111.851 -174.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -124.63 -79.35 0.39 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.009 -1.091 . . . . 60.409999999999997 112.542 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.681 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -157.62 -56.66 0.08 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.756 0.313 . . . . 64.019999999999996 110.369 -175.099 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.983 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 63.75 12.71 6.87 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.421 -0.809 . . . . 52.340000000000003 112.703 177.763 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -105.39 -26.56 11.91 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.334 -0.547 . . . . 74.319999999999993 111.191 -176.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 28' ' ' ARG . 13.5 mm-40 -97.84 -3.21 39.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.087 0.47 . . . . 51.43 110.758 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.697 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.7 mp -73.21 135.31 44.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.148 -0.478 . . . . 62.200000000000003 110.636 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 . . . . . 0 C--N 1.326 -0.449 0 CA-C-O 121.326 0.584 . . . . 75.329999999999998 110.581 -178.791 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ttt . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 120.889 0.376 . . . . 71.140000000000001 110.22 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 156.49 155.09 7.27 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 111.368 -0.693 . . . . 44.109999999999999 111.368 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.5 m -153.49 92.89 1.63 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.96 0.41 . . . . 70.329999999999998 110.639 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.2 p -107.83 66.93 0.67 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.453 0.644 . . . . 50.119999999999997 110.327 178.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -156.14 131.35 9.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.329 -0.85 . . . . 72.519999999999996 109.475 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -148.36 152.97 37.95 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.53 -0.304 . . . . 70.319999999999993 110.891 -177.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.6 t-80 -156.53 81.25 0.96 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.491 -0.559 . . . . 74.049999999999997 109.491 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -154.78 76.69 1.01 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.055 -0.52 . . . . 74.319999999999993 110.475 -175.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -177.11 114.17 0.09 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.349 -0.387 . . . . 61.229999999999997 110.962 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -163.58 17.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.026 0.441 . . . . 74.209999999999994 110.618 170.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.9 m -79.97 106.69 12.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.378 -0.373 . . . . 72.400000000000006 110.433 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.0 m -158.07 130.43 7.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.204 -0.453 . . . . 74.340000000000003 110.516 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 123.62 50.7 0.21 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.223 -0.989 . . . . 55.200000000000003 113.261 175.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -102.09 88.89 3.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.955 0.407 . . . . 75.109999999999999 110.512 174.075 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 115.875 -0.602 . . . . 64.519999999999996 110.662 177.448 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.4 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.1 mp . . . . . 0 CA--C 1.522 -0.111 0 N-CA-C 109.679 -0.489 . . . . 73.239999999999995 109.679 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 ttt180 -134.52 133.31 40.19 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.78 -0.452 . . . . 74.219999999999999 109.78 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.567 ' CA ' ' HG ' ' A' ' 71' ' ' LEU . 1.8 pt-20 -73.28 127.7 33.38 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.097 -0.705 . . . . 71.519999999999996 109.097 -179.04 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 45.3 tp -104.54 -29.84 10.4 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.579 -0.737 . . . . 65.439999999999998 111.132 -171.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.403 ' CD2' ' HB ' ' A' ' 70' ' ' VAL . 1.6 pt? -163.73 158.67 20.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.045 0.45 . . . . 75.129999999999995 111.253 -176.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -145.8 128.33 16.04 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.567 -0.901 . . . . 73.400000000000006 108.567 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.5 t -143.09 162.15 36.29 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.391 0.615 . . . . 73.040000000000006 111.698 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -106.77 2.03 25.33 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.256 -0.884 . . . . 65.5 110.414 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -96.54 119.9 35.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.981 -0.554 . . . . 75.319999999999993 109.822 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.32 -45.94 68.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.181 -0.463 . . . . 74.019999999999996 111.981 -174.29 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.2 t -66.51 -46.63 85.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.396 -0.365 . . . . 61.25 111.009 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.8 tp -61.59 -41.5 97.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.766 0.317 . . . . 71.140000000000001 110.396 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.43 HD11 ' HB3' ' A' ' 68' ' ' ARG . 4.7 tt -59.46 -44.55 92.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.937 -0.574 . . . . 61.210000000000001 110.011 177.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.8 m -65.31 -41.54 93.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.868 -0.605 . . . . 71.319999999999993 110.711 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.43 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -62.01 -51.87 66.27 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.084 -0.507 . . . . 61.310000000000002 111.087 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.457 ' HA ' HD12 ' A' ' 41' ' ' LEU . 99.2 t -63.81 -40.46 89.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.089 0.471 . . . . 74.409999999999997 110.927 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.34 -42.24 99.72 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.796 -0.638 . . . . 54.329999999999998 112.297 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.08 -34.03 77.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.805 0.336 . . . . 63.0 110.825 178.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.551 ' HB3' HD21 ' A' ' 83' ' ' LEU . 97.8 mt -62.43 -49.1 76.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.285 0.564 . . . . 73.510000000000005 110.5 177.637 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.539 HD12 HG11 ' A' ' 70' ' ' VAL . 75.3 mt -70.94 -42.53 69.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.578 -0.737 . . . . 63.310000000000002 111.044 -176.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -67.13 -35.53 79.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.953 0.406 . . . . 64.430000000000007 110.627 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.1 -23.05 72.87 Favored Glycine 0 C--O 1.229 -0.194 0 C-N-CA 121.027 -0.606 . . . . 64.129999999999995 112.281 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.19 11.78 20.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.929 0.395 . . . . 33.530000000000001 110.528 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.0 t70 68.63 6.26 5.37 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.309 -0.86 . . . . 72.340000000000003 111.294 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 60.6 mt -73.6 -24.19 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.648 0.737 . . . . 50.229999999999997 109.042 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.05 -153.43 51.16 Favored Glycine 0 N--CA 1.441 -1.014 0 CA-C-N 114.779 -1.1 . . . . 55.030000000000001 111.573 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -173.15 143.39 1.12 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.654 0.264 . . . . 75.340000000000003 110.702 176.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.897 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 41.8 tp -108.45 88.28 2.69 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 108.781 -0.822 . . . . 62.210000000000001 108.781 168.704 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.539 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 24.0 m . . . . . 0 C--N 1.325 -0.459 0 CA-C-O 121.974 0.893 . . . . 52.32 109.644 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo . . . . . 0 N--CA 1.463 -0.295 0 N-CA-C 111.421 -0.261 . . . . 72.450000000000003 111.421 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.43 ' HB3' HD11 ' A' ' 35' ' ' LEU . 50.3 ttm-85 -62.03 136.91 58.16 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.058 -0.519 . . . . 64.120000000000005 109.997 -178.759 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 32.0 ptt180 -122.18 157.59 31.23 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.444 -0.343 . . . . 73.030000000000001 110.476 -175.09 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.539 HG11 HD12 ' A' ' 42' ' ' LEU . 24.7 t -112.53 116.32 52.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.833 -0.621 . . . . 62.210000000000001 110.393 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.897 ' HB2' ' HB3' ' A' ' 50' ' ' LEU . 8.9 mp -101.99 129.58 48.32 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.08 -0.509 . . . . 63.340000000000003 110.288 176.207 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 29.5 m -108.94 -173.68 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.585 -0.734 . . . . 52.229999999999997 109.571 177.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -97.59 143.71 28.0 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.839 -0.344 . . . . 74.019999999999996 110.621 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -40.19 -54.61 2.3 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.373 1.249 . . . . 54.43 114.373 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -80.8 -19.07 45.53 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.063 0.458 . . . . 73.450000000000003 111.196 -171.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -83.2 2.24 36.66 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.832 -0.622 . . . . 75.430000000000007 110.783 -177.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -54.89 -44.65 74.31 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.424 -0.353 . . . . 54.240000000000002 110.673 176.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.37 83.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.99 -0.55 . . . . 41.439999999999998 111.177 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -69.1 -46.7 57.48 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.661 -0.781 . . . . 41.310000000000002 111.862 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.21 96.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.681 -0.259 . . . . 73.219999999999999 111.582 -178.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 55.2 mtp85 -59.0 -48.64 80.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.998 -0.547 . . . . 64.409999999999997 111.357 -178.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -64.58 -45.69 85.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.989 0.423 . . . . 62.049999999999997 110.564 179.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.551 HD21 ' HB3' ' A' ' 41' ' ' LEU . 59.4 tp -55.67 -55.58 30.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.283 -0.872 . . . . 74.120000000000005 111.802 -175.484 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 68.7 mt -69.21 -32.06 71.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.243 -0.435 . . . . 71.129999999999995 111.745 -176.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 82.5 m -72.35 -44.84 62.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.599 0.238 . . . . 70.109999999999999 111.218 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -69.73 -25.65 63.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.032 0.444 . . . . 64.0 110.542 -178.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.66 -10.48 59.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.965 -0.562 . . . . 72.109999999999999 110.941 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 72.94 30.35 63.54 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.222 -0.513 . . . . 34.100000000000001 112.73 178.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.4 mt -118.29 17.74 13.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.055 0.455 . . . . 72.340000000000003 111.057 -178.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.632 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -77.83 85.43 4.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.252 -0.431 . . . . 60.439999999999998 110.29 178.396 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -141.18 -40.37 0.39 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.826 -0.624 . . . . 71.109999999999999 110.657 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -88.34 -1.28 57.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.463 -0.335 . . . . 73.319999999999993 111.349 -177.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.632 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.1 mp -65.97 118.42 9.74 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.998 -0.371 . . . . 64.310000000000002 109.998 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 C-N-CA 120.718 -0.393 . . . . 73.239999999999995 111.597 -172.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.5 ttp . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.002 -0.37 . . . . 72.140000000000001 110.002 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -172.46 45.38 0.17 Allowed Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.611 -0.596 . . . . 63.229999999999997 111.611 -179.18 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.6 p -88.07 83.4 7.01 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.214 0.531 . . . . 65.25 111.064 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t -124.2 113.84 18.84 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.108 -0.701 . . . . 62.200000000000003 109.108 179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -104.6 117.25 33.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.507 -0.315 . . . . 70.329999999999998 110.267 -175.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -145.63 105.67 4.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.179 -0.464 . . . . 75.340000000000003 109.862 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -168.23 32.92 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.306 0.575 . . . . 71.519999999999996 109.664 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 -80.66 129.51 34.56 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.774 -0.648 . . . . 70.430000000000007 110.886 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -141.1 107.73 5.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.274 -0.421 . . . . 61.149999999999999 110.754 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.464 ' HA ' ' OD2' ' A' ' 46' ' ' ASP . 55.8 t-80 -60.98 107.67 0.75 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.932 -0.576 . . . . 75.319999999999993 110.799 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.403 ' H ' ' HB3' ' A' ' 46' ' ' ASP . 16.4 m -116.9 -1.01 12.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.122 0.487 . . . . 54.409999999999997 111.067 -178.152 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.6 p -87.52 88.99 7.83 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.243 0.544 . . . . 63.149999999999999 110.779 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -122.42 63.9 0.52 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.651 -0.785 . . . . 33.130000000000003 112.844 -177.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -163.03 111.18 1.26 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.982 0.42 . . . . 74.530000000000001 111.742 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.652 0 N-CA-C 108.416 -0.957 . . . . 63.210000000000001 108.416 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.476 HD22 HD22 ' A' ' 50' ' ' LEU . 6.6 mp . . . . . 0 N--CA 1.455 -0.221 0 CA-C-O 120.816 0.341 . . . . 72.439999999999998 110.893 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -127.41 155.77 43.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.837 -0.62 . . . . 70.25 110.957 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.845 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 42.7 tt0 -74.92 117.4 16.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.98 -0.555 . . . . 64.530000000000001 110.378 -179.168 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 26' ' ' LEU . 10.0 mt -86.1 -45.34 11.48 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.069 -0.514 . . . . 73.219999999999999 111.566 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.1 tp -140.04 139.77 36.03 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.084 -0.507 . . . . 73.219999999999999 111.262 -165.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -115.49 94.94 4.92 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.331 -0.85 . . . . 73.239999999999995 108.712 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.423 ' O ' ' HB3' ' A' ' 68' ' ' ARG . 43.0 m -137.74 104.74 5.39 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.247 0.546 . . . . 73.25 112.403 -169.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -89.74 -1.05 57.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.246 0.546 . . . . 73.299999999999997 109.727 174.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -68.88 -33.98 74.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.142 -0.936 . . . . 75.209999999999994 111.682 -176.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 73.23 -50.85 0.7 Allowed 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.663 0.785 . . . . 75.219999999999999 112.096 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 56.3 t -66.64 -49.15 77.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.689 0.28 . . . . 62.020000000000003 110.521 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.5 tp -56.93 -38.29 72.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.197 0.522 . . . . 75.099999999999994 110.287 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.404 ' O ' HD23 ' A' ' 35' ' ' LEU . 6.0 tt -63.69 -32.75 74.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 74.540000000000006 110.562 -179.416 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.7 m -61.83 -37.04 82.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.995 0.426 . . . . 61.310000000000002 110.888 -179.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.3 -42.99 74.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 73.230000000000004 110.649 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 85.1 t -67.14 -42.49 88.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.008 -0.542 . . . . 74.420000000000002 110.612 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.96 -35.03 89.96 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.773 -0.649 . . . . 44.310000000000002 112.486 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -32.89 74.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.708 0.289 . . . . 63.109999999999999 110.796 178.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.3 mt -69.31 -49.5 55.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.462 . . . . 71.209999999999994 110.477 178.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.566 ' HA ' HD12 ' A' ' 47' ' ' ILE . 76.2 mt -62.75 -55.16 29.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.703 -0.68 . . . . 64.109999999999999 111.077 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.37 -25.07 67.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 64.209999999999994 111.214 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.53 -30.65 75.11 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 121.062 -0.589 . . . . 74.219999999999999 112.431 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -109.76 8.16 24.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.963 0.411 . . . . 53.310000000000002 110.63 178.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.464 ' OD2' ' HA ' ' A' ' 10' ' ' HIS . 26.2 t0 56.52 43.24 26.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 122.021 0.915 . . . . 63.549999999999997 110.623 -175.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.566 HD12 ' HA ' ' A' ' 42' ' ' LEU . 68.0 mt -67.66 -27.46 38.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 114.949 -1.023 . . . . 71.329999999999998 109.816 174.07 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.56 -178.79 35.52 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.163 -0.926 . . . . 73.439999999999998 111.468 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -165.81 125.31 1.69 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.018 0.437 . . . . 75.510000000000005 111.618 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.671 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 61.7 tp -105.88 100.14 9.7 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 107.988 -1.115 . . . . 73.329999999999998 107.988 166.186 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.434 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 21.9 m . . . . . 0 C--N 1.319 -0.729 0 CA-C-N 116.473 -0.331 . . . . 50.340000000000003 111.755 -172.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 N--CA 1.452 -0.96 0 CA-C-O 121.141 0.392 . . . . 65.430000000000007 111.41 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 29' ' ' THR . 24.0 ttm180 -72.97 117.85 15.2 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.268 -0.642 . . . . 73.109999999999999 109.268 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.434 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 8.9 ptp85 -113.84 134.48 54.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.783 -0.644 . . . . 72.140000000000001 111.236 -172.23 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 24.4 t -101.71 127.43 55.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.896 -0.593 . . . . 72.400000000000006 110.526 174.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.845 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.9 mp -121.66 147.68 45.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.794 -0.185 . . . . 63.329999999999998 111.115 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.515 HG23 HD22 ' A' ' 77' ' ' LEU . 35.7 m -134.67 178.76 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 109.441 -0.577 . . . . 72.530000000000001 109.441 173.489 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 23' ' ' LEU . 7.4 p80 -96.65 177.14 5.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.73 0.3 . . . . 63.310000000000002 111.635 -174.403 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.24 169.43 8.73 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.142 -0.481 . . . . 61.109999999999999 111.855 -178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.1 t70 66.77 -65.39 0.21 Allowed 'General case' 0 N--CA 1.471 0.587 0 O-C-N 124.03 0.831 . . . . 64.319999999999993 109.877 -174.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -54.32 -26.56 30.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.677 -1.147 . . . . 70.420000000000002 111.164 176.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.515 HD22 HG23 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -50.03 -40.66 45.55 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.798 -0.637 . . . . 62.240000000000002 110.554 178.357 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.52 -41.46 69.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 54.109999999999999 110.872 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.23 -45.33 81.59 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.085 -0.579 . . . . 74.349999999999994 112.145 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.34 93.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.653 0.263 . . . . 75.150000000000006 110.855 178.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 30.1 mtp180 -60.2 -48.71 80.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.448 -0.342 . . . . 75.340000000000003 110.717 177.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -59.34 -40.52 86.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.062 -0.517 . . . . 73.319999999999993 110.688 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 42.0 tp -61.79 -49.45 76.31 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.888 -0.596 . . . . 73.299999999999997 110.809 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.6 mp -68.28 -29.03 67.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.088 -0.505 . . . . 51.039999999999999 111.4 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 51.1 m -69.56 -45.27 69.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.764 0.316 . . . . 53.219999999999999 110.251 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -62.4 -36.93 83.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 74.129999999999995 110.832 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.26 -18.09 60.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.92 -0.582 . . . . 74.099999999999994 111.153 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 83.02 23.37 55.53 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.123 -0.56 . . . . 55.140000000000001 113.02 177.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.1 mt -107.01 -3.03 20.51 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 122.541 -0.388 . . . . 51.32 111.186 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.781 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -75.56 86.23 2.65 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.352 -0.385 . . . . 61.240000000000002 111.152 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -147.16 -43.26 0.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.113 -0.494 . . . . 64.409999999999997 110.757 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -91.75 18.53 7.51 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.35 0.595 . . . . 60.299999999999997 110.69 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.781 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.7 mp -82.18 167.02 19.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.66 -0.7 . . . . 73.439999999999998 111.525 -177.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.597 ' HD2' ' OE1' ' A' ' 25' ' ' GLU . 28.0 ttt180 . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 115.471 -0.786 . . . . 71.319999999999993 109.4 177.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mpp? . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 110.085 -0.339 . . . . 72.109999999999999 110.085 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -174.17 70.15 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.998 -0.62 . . . . 71.019999999999996 111.839 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 m -106.94 26.18 10.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.976 0.417 . . . . 53.399999999999999 110.395 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.2 m -92.1 112.33 24.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.462 0.649 . . . . 55.439999999999998 111.525 -175.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.1 m170 -118.84 113.21 20.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.598 -0.728 . . . . 73.430000000000007 109.724 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -110.52 115.3 29.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.06 0.457 . . . . 74.019999999999996 109.903 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.4 p80 -151.76 134.74 15.74 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.973 -0.558 . . . . 73.349999999999994 110.429 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -150.97 123.66 8.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.833 -0.621 . . . . 73.0 110.086 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.76 88.54 1.41 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.355 -0.384 . . . . 71.230000000000004 110.551 -175.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -164.25 134.11 4.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.277 -0.638 . . . . 72.219999999999999 109.277 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.2 m -157.61 110.74 2.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.639 0.257 . . . . 63.539999999999999 111.282 -178.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 p -166.23 143.72 5.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 42.43 110.441 174.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 150.04 108.4 0.44 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.89 -0.672 . . . . 74.25 112.114 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 -173.41 -60.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.985 0.421 . . . . 72.099999999999994 110.383 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.438 -0.801 . . . . 72.120000000000005 111.816 -172.399 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.553 HD21 HD13 ' A' ' 50' ' ' LEU . 5.7 mp . . . . . 0 C--O 1.234 0.255 0 N-CA-C 110.149 -0.315 . . . . 74.329999999999998 110.149 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 24' ' ' ARG . 50.6 mtm180 -111.34 170.32 8.2 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.996 -0.372 . . . . 74.439999999999998 109.996 173.102 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.669 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 36.6 tt0 -81.82 135.06 35.47 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.79 0.329 . . . . 72.049999999999997 111.29 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.837 HD21 HG22 ' A' ' 72' ' ' VAL . 4.4 mm? -97.23 -67.19 0.86 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.056 -0.52 . . . . 71.340000000000003 110.034 175.317 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.633 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -142.82 157.9 44.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.24 -0.437 . . . . 72.430000000000007 110.559 177.938 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -138.01 101.73 4.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.828 -0.804 . . . . 63.509999999999998 108.828 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.0 t -113.59 170.25 8.38 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.242 -0.436 . . . . 74.310000000000002 110.525 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 68.8 m-20 -104.57 -3.78 23.42 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.066 0.46 . . . . 74.530000000000001 109.768 177.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -105.98 156.71 18.1 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.734 -0.666 . . . . 73.430000000000007 111.174 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.73 -15.13 11.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.199 -0.455 . . . . 73.109999999999999 110.999 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 82.5 t -71.75 -49.51 45.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.007 0.432 . . . . 74.040000000000006 110.744 -177.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.4 tp -59.86 -31.78 70.09 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.886 -0.597 . . . . 72.109999999999999 110.684 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 76.3 mt -67.58 -22.98 65.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.506 . . . . 73.200000000000003 111.54 -178.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.6 m -67.97 -36.9 80.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.007 0.432 . . . . 73.129999999999995 110.238 176.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -72.18 -45.35 60.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 74.109999999999999 110.317 177.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.7 t -63.81 -42.77 96.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.76 -0.654 . . . . 61.549999999999997 110.972 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.35 -37.42 94.03 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.816 -0.629 . . . . 62.229999999999997 112.239 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.42 -31.3 72.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.758 0.314 . . . . 75.25 111.006 178.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 91.0 mt -70.42 -51.02 32.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.959 0.409 . . . . 73.129999999999995 110.159 177.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.672 ' HA ' HD12 ' A' ' 47' ' ' ILE . 48.3 mt -58.67 -52.87 63.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.602 -0.726 . . . . 72.319999999999993 110.969 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -67.75 -34.35 76.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.601 -0.727 . . . . 54.130000000000003 111.168 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.62 -15.2 61.51 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 116.12 -0.491 . . . . 63.25 112.443 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -100.76 -65.58 0.96 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.563 0.221 . . . . 64.329999999999998 110.609 176.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.0 t70 164.37 -19.78 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.402 -0.817 . . . . 73.329999999999998 109.09 -173.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.672 HD12 ' HA ' ' A' ' 42' ' ' LEU . 23.9 mt -51.04 106.41 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 114.179 -1.373 . . . . 74.219999999999999 112.869 -166.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.59 114.16 6.44 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.414 -0.812 . . . . 40.109999999999999 111.274 173.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -127.34 130.45 49.47 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.931 0.396 . . . . 75.319999999999993 110.647 -173.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.553 HD13 HD21 ' A' ' 23' ' ' LEU . 8.7 mp -106.66 112.16 25.02 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.858 -0.61 . . . . 75.319999999999993 110.05 179.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 C--N 1.323 -0.564 0 CA-C-N 115.86 -0.609 . . . . 64.450000000000003 110.512 179.143 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo . . . . . 0 N--CA 1.463 -0.272 0 CA-C-O 120.633 0.181 . . . . 71.319999999999993 111.76 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -158.08 116.63 3.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.11 -0.495 . . . . 75.340000000000003 110.367 175.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -113.91 132.41 55.94 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.739 -0.664 . . . . 75.109999999999999 109.33 177.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.402 ' C ' HD12 ' A' ' 71' ' ' LEU . 52.2 t -109.74 118.49 56.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.405 -0.361 . . . . 61.219999999999999 110.448 -177.041 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.669 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.5 mp -125.74 144.37 50.65 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.996 -0.547 . . . . 62.200000000000003 109.914 177.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.837 HG22 HD21 ' A' ' 26' ' ' LEU . 33.2 m -127.68 165.66 26.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.931 -0.396 . . . . 75.340000000000003 109.931 177.098 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.488 ' ND1' ' HB3' ' A' ' 75' ' ' ASP . 0.4 OUTLIER -69.59 133.82 48.06 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.582 -0.281 . . . . 62.539999999999999 110.504 178.307 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.481 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 43.7 mm-40 -51.5 -28.46 13.55 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.137 0.575 . . . . 72.549999999999997 111.945 -177.728 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.488 ' HB3' ' ND1' ' A' ' 73' ' ' HIS . 34.9 t70 -58.4 -17.7 22.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.453 -0.794 . . . . 71.0 112.124 -179.138 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -131.59 13.24 4.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.157 0.503 . . . . 71.510000000000005 109.928 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -57.3 -51.21 70.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.983 -0.553 . . . . 73.099999999999994 110.883 -174.441 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.16 -36.2 82.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.904 -0.589 . . . . 54.32 111.459 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.61 -47.39 21.32 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.627 -0.797 . . . . 71.230000000000004 111.956 -179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.05 -44.67 87.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.691 0.256 . . . . 71.400000000000006 111.691 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -59.68 -49.13 78.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.695 -0.229 . . . . 63.229999999999997 111.575 -177.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -65.56 -35.28 80.39 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.424 -0.51 . . . . 72.400000000000006 110.712 -178.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.2 tp -61.97 -43.07 99.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.932 0.396 . . . . 75.329999999999998 110.211 178.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.73 -28.54 66.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.0 -0.546 . . . . 74.310000000000002 111.236 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.41 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 19.2 m -77.33 -48.81 16.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.164 0.507 . . . . 64.010000000000005 110.781 176.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.04 -44.39 76.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.167 -0.924 . . . . 65.019999999999996 112.122 -171.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -123.06 28.3 7.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.89 0.376 . . . . 44.43 111.747 -175.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -139.96 -80.98 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.103 -1.046 . . . . 73.540000000000006 112.252 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.54 HD13 ' OE1' ' A' ' 92' ' ' GLU . 0.6 OUTLIER -179.12 -57.12 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 122.321 0.248 . . . . 63.009999999999998 111.187 -173.434 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.988 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . 60.12 20.99 10.24 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.025 0.53 . . . . 74.439999999999998 112.055 -177.048 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' HIS . . . . . 0.476 ' H ' HD12 ' A' ' 89' ' ' LEU . 57.1 t-80 -100.67 -29.27 12.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.089 0.471 . . . . 73.129999999999995 110.651 -176.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.54 ' OE1' HD13 ' A' ' 89' ' ' LEU . 5.4 mp0 -94.75 6.96 47.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.823 -0.626 . . . . 75.450000000000003 110.701 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.988 HD13 ' HA ' ' A' ' 90' ' ' ALA . 11.1 mp -73.13 150.61 42.08 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.205 -0.452 . . . . 74.150000000000006 110.701 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 94' ' ' ARG . 22.3 ttt85 . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 115.533 -0.758 . . . . 72.340000000000003 109.755 -173.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 mmt . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.748 0.308 . . . . 52.439999999999998 110.201 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 106.98 56.9 0.61 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.929 -0.653 . . . . 63.329999999999998 112.299 177.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.7 m -116.82 78.54 1.22 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.037 0.446 . . . . 71.230000000000004 110.697 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.2 m -127.03 144.52 51.0 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.08 -0.509 . . . . 73.010000000000005 110.435 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -134.71 101.58 4.98 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.182 -0.673 . . . . 62.149999999999999 109.182 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.7 t60 -135.58 125.94 26.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.856 -0.611 . . . . 75.439999999999998 111.165 -172.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -150.3 132.98 15.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.157 -0.474 . . . . 70.129999999999995 109.903 173.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 t60 -132.8 108.95 9.31 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.724 -0.473 . . . . 72.420000000000002 109.724 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -152.04 98.5 2.44 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.302 -0.408 . . . . 74.439999999999998 111.107 -175.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -157.14 113.0 2.9 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.354 0.597 . . . . 55.530000000000001 110.344 173.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.7 m -134.5 137.23 43.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.6 -0.727 . . . . 75.129999999999995 109.661 178.186 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.3 m -139.55 167.04 22.99 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.038 -0.528 . . . . 73.209999999999994 110.122 -176.071 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 141.51 85.52 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.131 -1.033 . . . . 75.109999999999999 113.728 174.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 17.1 ptt180 -149.82 100.88 3.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.233 0.539 . . . . 73.439999999999998 110.692 172.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 116.019 -0.537 . . . . 73.140000000000001 110.275 178.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 93.2 mt . . . . . 0 N--CA 1.467 0.393 0 CA-C-O 121.205 0.526 . . . . 72.230000000000004 110.509 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.529 ' HB2' HD21 ' A' ' 77' ' ' LEU . 27.8 mmm180 -132.74 127.52 34.88 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.992 -0.442 . . . . 62.009999999999998 110.889 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.546 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 42.5 tt0 -70.56 120.93 16.92 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.557 -0.747 . . . . 74.340000000000003 109.05 174.464 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.46 HD12 HD22 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -79.6 -51.96 8.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.889 0.376 . . . . 74.530000000000001 110.098 -174.895 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.46 HD22 HD12 ' A' ' 26' ' ' LEU . 2.7 pt? -157.4 154.53 29.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.177 -0.465 . . . . 74.430000000000007 110.701 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.569 ' HG3' ' HB3' ' A' ' 69' ' ' ARG . 22.1 ttm180 -131.7 111.41 11.65 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.702 -0.851 . . . . 74.239999999999995 108.702 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.7 t -126.92 164.7 20.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.138 0.494 . . . . 72.340000000000003 111.523 -173.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -107.88 -6.89 16.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.655 -0.702 . . . . 74.439999999999998 109.955 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -95.45 134.47 38.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.763 -0.653 . . . . 74.129999999999995 111.332 -175.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.35 -33.26 49.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.813 -0.63 . . . . 73.400000000000006 111.587 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.1 t -59.96 -47.44 91.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 120.93 0.395 . . . . 63.049999999999997 110.69 -177.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.3 tp -62.22 -40.24 95.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.672 -0.695 . . . . 75.340000000000003 110.572 178.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.63 -43.41 98.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 63.520000000000003 111.081 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.6 m -59.5 -40.78 88.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.791 0.329 . . . . 55.420000000000002 111.016 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -71.97 -54.64 9.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.117 -0.492 . . . . 42.210000000000001 111.181 -177.528 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.403 HG13 HD21 ' A' ' 84' ' ' LEU . 86.9 t -61.26 -39.53 82.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.194 0.521 . . . . 73.450000000000003 110.315 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.82 -49.0 80.33 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.351 -0.841 . . . . 71.040000000000006 112.262 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.28 -33.02 74.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.639 0.257 . . . . 71.540000000000006 111.305 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 95.0 mt -65.68 -51.78 56.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.323 -0.399 . . . . 63.420000000000002 110.678 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.6 mt -74.39 -27.3 60.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.113 -0.494 . . . . 71.040000000000006 110.671 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -74.91 -55.63 5.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.13 -0.486 . . . . 61.520000000000003 110.631 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.66 -36.2 92.06 Favored Glycine 0 C--N 1.332 0.31 0 CA-C-N 115.698 -0.683 . . . . 70.310000000000002 112.84 -175.095 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.487 ' HB3' HG12 ' A' ' 47' ' ' ILE . . . -82.81 -1.69 52.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.763 0.316 . . . . 72.219999999999999 110.747 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.2 t70 60.72 26.78 16.55 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.462 0.648 . . . . 74.319999999999993 111.067 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.487 HG12 ' HB3' ' A' ' 45' ' ' ALA . 47.2 mm -63.64 -39.32 84.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.532 0.682 . . . . 52.219999999999999 110.106 -179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 110.64 125.79 4.9 Favored Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.208 -0.905 . . . . 61.539999999999999 112.276 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -139.0 141.81 38.32 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.71 0.291 . . . . 73.010000000000005 110.683 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.6 90.67 3.37 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.313 -0.995 . . . . 74.319999999999993 108.313 171.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.9 m . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.974 -0.557 . . . . 72.409999999999997 111.499 -175.581 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo . . . . . 0 C--O 1.235 0.345 0 CA-C-O 120.932 0.305 . . . . 61.229999999999997 111.708 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.486 ' HA ' ' HD2' ' A' ' 68' ' ' ARG . 10.1 tpt180 -100.87 140.81 34.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.38 0.61 . . . . 72.310000000000002 110.985 -177.598 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.569 ' HB3' ' HG3' ' A' ' 28' ' ' ARG . 28.3 ptt180 -113.61 146.69 39.35 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.135 -0.939 . . . . 74.109999999999999 110.357 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 64.6 t -110.04 116.75 53.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.415 -0.357 . . . . 61.409999999999997 110.444 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.7 mp -102.79 137.62 40.76 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.548 -0.538 . . . . 65.209999999999994 109.548 174.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 25.3 m -114.99 176.9 2.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.227 -0.442 . . . . 65.340000000000003 110.504 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -69.9 129.33 39.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.686 -0.688 . . . . 75.319999999999993 109.519 176.17 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.401 ' H ' ' HG2' ' A' ' 74' ' ' GLU . 5.9 pt-20 -57.75 -35.93 71.39 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.006 0.431 . . . . 64.049999999999997 111.125 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.6 -16.91 61.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.731 -0.668 . . . . 63.409999999999997 110.142 -176.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -111.33 23.62 13.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.964 -0.562 . . . . 71.540000000000006 110.093 -175.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.529 HD21 ' HB2' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -51.32 -50.86 58.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.753 -0.658 . . . . 71.099999999999994 110.711 -178.436 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.13 -28.37 66.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.019 -0.537 . . . . 64.319999999999993 111.622 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.42 -57.23 5.18 Favored Glycine 0 C--O 1.236 0.23 0 C-N-CA 120.718 -0.754 . . . . 71.409999999999997 112.611 -175.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.38 -42.87 96.75 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.889 0.329 . . . . 73.120000000000005 111.889 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 14.6 ptm180 -67.22 -33.23 74.91 Favored 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 120.943 -0.303 . . . . 72.329999999999998 110.91 -178.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -63.0 -42.28 99.81 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.016 0.436 . . . . 73.530000000000001 109.852 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 34.8 tp -58.49 -46.99 85.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.6 -0.727 . . . . 70.239999999999995 110.451 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.403 HD21 HG13 ' A' ' 38' ' ' VAL . 84.0 mt -68.49 -32.46 72.47 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.768 -0.651 . . . . 64.310000000000002 111.226 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.6 m -70.37 -36.82 74.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.975 0.417 . . . . 61.039999999999999 110.551 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -69.04 -40.58 78.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.019 -0.537 . . . . 64.019999999999996 110.445 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.48 -30.16 69.78 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.868 -0.605 . . . . 73.200000000000003 111.044 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 100.29 -13.79 59.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.121 -0.562 . . . . 73.319999999999993 112.673 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 61.6 mt -78.91 1.9 21.99 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.178 0.436 . . . . 63.530000000000001 112.178 -176.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -75.73 91.32 2.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.056 0.455 . . . . 62.119999999999997 109.827 175.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -140.46 -40.32 0.42 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.904 -0.589 . . . . 75.129999999999995 110.001 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.6 mp0 -87.39 29.63 0.85 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.627 -0.715 . . . . 71.340000000000003 111.492 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.552 HD12 ' H ' ' A' ' 93' ' ' LEU . 4.1 mp -62.81 145.1 55.76 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.705 0.288 . . . . 70.140000000000001 110.482 -178.519 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.431 ' HD2' ' HA ' ' A' ' 94' ' ' ARG . 2.3 tpt180 . . . . . 0 C--N 1.323 -0.585 0 N-CA-C 109.728 -0.471 . . . . 71.450000000000003 109.728 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.484 1.255 0 CA-C-O 120.529 0.204 . . . . 72.25 110.986 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.18 127.59 0.92 Allowed Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 120.222 -0.99 . . . . 54.119999999999997 113.065 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.2 p -153.4 82.24 1.18 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.224 -0.658 . . . . 63.409999999999997 109.224 173.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.3 p -89.51 117.76 28.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.78 -0.645 . . . . 74.140000000000001 111.471 -172.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -139.37 111.44 7.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.087 -0.708 . . . . 73.430000000000007 109.087 176.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.6 p-80 -153.38 107.26 3.04 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.081 0.467 . . . . 70.140000000000001 111.18 -177.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -150.7 102.34 3.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.893 -0.594 . . . . 73.030000000000001 111.138 175.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -140.79 118.86 11.92 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.351 -0.611 . . . . 74.209999999999994 109.351 171.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -146.13 95.22 2.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.224 -0.444 . . . . 72.400000000000006 110.639 -177.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -131.76 53.23 2.01 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.814 -0.81 . . . . 64.010000000000005 108.814 174.145 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -72.46 90.87 1.34 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.324 -0.853 . . . . 72.200000000000003 110.813 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.3 p -121.4 -178.13 3.71 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.84 -0.618 . . . . 75.209999999999994 110.32 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 106.76 90.17 2.14 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.779 -0.724 . . . . 64.019999999999996 111.691 -179.063 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 14' ' ' ARG . 10.4 ttp180 -76.64 -65.17 0.97 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.641 -0.503 . . . . 62.329999999999998 109.641 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.302 -0.863 . . . . 55.240000000000002 110.093 -176.142 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.767 HD22 ' HB2' ' A' ' 50' ' ' LEU . 7.4 mp . . . . . 0 CA--C 1.531 0.242 0 CA-C-O 121.665 0.745 . . . . 64.530000000000001 111.518 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.634 ' HB2' HD11 ' A' ' 77' ' ' LEU . 13.1 mmt180 -115.2 133.18 56.27 Favored 'General case' 0 C--N 1.321 -0.668 0 O-C-N 121.831 -0.543 . . . . 65.530000000000001 110.545 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.589 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.5 tt0 -66.93 126.96 30.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.22 -0.9 . . . . 75.329999999999998 110.409 -176.247 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.477 ' CD1' ' HG2' ' A' ' 81' ' ' ARG . 20.2 tp -106.61 -58.21 1.96 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.41 -0.814 . . . . 72.040000000000006 110.772 -175.484 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.842 ' HB3' HD23 ' A' ' 93' ' ' LEU . 4.6 pp -147.71 167.99 23.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.388 -0.369 . . . . 63.549999999999997 110.1 178.508 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.538 ' HD2' ' O ' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -148.02 143.91 27.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.88 0.372 . . . . 75.129999999999995 111.527 179.213 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.8 t -174.02 163.17 3.96 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.605 -0.725 . . . . 62.310000000000002 109.995 178.002 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -100.06 -4.23 30.3 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.958 0.409 . . . . 54.25 109.924 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.8 117.68 17.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.766 -0.652 . . . . 75.439999999999998 110.344 -177.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.514 ' HB2' HH22 ' A' ' 68' ' ' ARG . . . -74.57 -38.44 62.68 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.323 -0.399 . . . . 64.109999999999999 111.263 -176.82 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.2 t -63.44 -46.44 95.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.088 0.471 . . . . 63.530000000000001 110.459 -177.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 tp -61.39 -39.95 92.56 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.696 -0.684 . . . . 70.450000000000003 110.584 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.556 ' HA ' HG12 ' A' ' 38' ' ' VAL . 80.9 mt -72.11 -24.65 61.52 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.957 -0.565 . . . . 75.239999999999995 111.514 -178.24 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -75.05 -27.59 60.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.945 0.403 . . . . 53.32 110.306 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.62 -53.74 7.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 71.409999999999997 110.582 177.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.73 HG21 HD21 ' A' ' 27' ' ' LEU . 7.2 p -64.92 -35.37 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 120.915 0.388 . . . . 65.439999999999998 111.153 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.37 -38.97 95.53 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.004 -0.617 . . . . 64.439999999999998 112.307 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.96 -29.98 70.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.878 0.371 . . . . 65.200000000000003 111.135 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 88.0 mt -69.39 -49.18 57.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.127 -0.488 . . . . 63.210000000000001 109.968 178.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.9 mt -66.15 -35.0 79.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.672 -0.695 . . . . 74.109999999999999 110.589 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.12 -52.43 48.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.769 -0.651 . . . . 73.109999999999999 110.737 176.196 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.53 -26.88 73.57 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.689 -0.687 . . . . 71.230000000000004 113.966 -173.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.02 9.11 37.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.835 0.318 . . . . 74.430000000000007 111.826 -177.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.6 t70 61.17 29.13 18.63 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.753 0.787 . . . . 73.510000000000005 110.732 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.3 mt -84.26 -47.62 17.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.541 0.686 . . . . 65.209999999999994 110.185 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.21 172.74 38.67 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.083 -0.962 . . . . 73.439999999999998 111.601 -176.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -169.24 142.13 2.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.946 0.403 . . . . 73.239999999999995 111.406 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.767 ' HB2' HD22 ' A' ' 23' ' ' LEU . 1.9 tm? -97.19 102.25 13.98 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.355 -0.98 . . . . 74.230000000000004 108.355 172.159 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.7 m . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.977 -0.556 . . . . 64.129999999999995 110.468 -179.611 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo . . . . . 0 N--CA 1.458 -0.581 0 N-CA-C 110.237 -0.717 . . . . 73.340000000000003 110.237 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.514 HH22 ' HB2' ' A' ' 32' ' ' ALA . 64.5 mtm180 -75.83 126.46 31.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.671 0.748 . . . . 73.140000000000001 112.337 -170.56 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -113.13 131.43 55.84 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.584 -1.189 . . . . 72.329999999999998 108.023 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 55.5 t -101.45 111.6 31.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-O 120.769 0.319 . . . . 75.439999999999998 110.772 -172.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.658 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 7.7 mp -102.73 142.73 33.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.639 -0.71 . . . . 74.0 109.104 174.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 20.6 m -119.96 174.26 5.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.204 0.526 . . . . 73.329999999999998 111.484 -174.057 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -57.69 121.89 11.48 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.812 -1.086 . . . . 64.049999999999997 110.949 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.565 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 36.9 mt-10 -62.87 154.0 31.47 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.879 -0.6 . . . . 71.219999999999999 109.459 177.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.565 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 8.6 t70 78.92 -16.79 0.64 Allowed 'General case' 0 N--CA 1.473 0.689 0 O-C-N 123.921 0.763 . . . . 71.349999999999994 111.213 -173.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.36 16.87 25.25 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.159 0.504 . . . . 73.219999999999999 110.246 -177.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.634 HD11 ' HB2' ' A' ' 24' ' ' ARG . 4.2 mm? -60.94 -49.09 78.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.671 -0.695 . . . . 61.340000000000003 111.295 -177.106 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.42 -22.46 66.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.912 0.387 . . . . 44.409999999999997 111.192 -178.365 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -84.61 -56.08 2.57 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.642 -0.79 . . . . 64.340000000000003 112.541 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.412 ' O ' HD13 ' A' ' 84' ' ' LEU . . . -61.17 -44.42 97.34 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.749 0.277 . . . . 65.150000000000006 111.749 -176.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.477 ' HG2' ' CD1' ' A' ' 26' ' ' LEU . 18.3 mtp180 -63.13 -36.96 85.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.937 0.399 . . . . 62.130000000000003 110.243 -178.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -68.34 -44.07 76.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.993 -0.548 . . . . 73.420000000000002 110.582 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.5 tp -56.28 -49.87 73.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 74.25 111.019 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.412 HD13 ' O ' ' A' ' 80' ' ' ALA . 9.1 mp -67.67 -28.23 67.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 75.340000000000003 111.416 -178.395 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.59 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.3 m -81.08 -40.02 24.79 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.47 -0.332 . . . . 74.519999999999996 111.211 -178.879 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -74.22 -42.28 60.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.27 -0.423 . . . . 63.420000000000002 111.217 -177.035 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.8 83.82 1.09 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.12 0.486 . . . . 62.109999999999999 110.361 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -170.33 -96.1 0.1 Allowed Glycine 0 N--CA 1.441 -1.01 0 C-N-CA 120.323 -0.942 . . . . 44.299999999999997 112.429 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.623 HD11 ' HB ' ' A' ' 38' ' ' VAL . 1.2 pp -175.0 48.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.197 0.522 . . . . 71.150000000000006 111.182 -172.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.59 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . -68.44 93.79 0.51 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.173 -0.467 . . . . 54.409999999999997 111.587 -177.034 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -151.14 -47.91 0.12 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.061 -0.518 . . . . 74.530000000000001 110.187 176.314 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -76.73 -0.3 23.19 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.64 -0.709 . . . . 75.340000000000003 110.869 -178.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.842 HD23 ' HB3' ' A' ' 27' ' ' LEU . 90.5 mt -66.91 140.47 57.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.004 -0.544 . . . . 73.299999999999997 110.671 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 . . . . . 0 C--N 1.324 -0.525 0 C-N-CA 120.85 -0.34 . . . . 74.310000000000002 110.193 175.94 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 109.775 -0.454 . . . . 54.210000000000001 109.775 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 174.82 -62.2 0.11 Allowed Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.591 -0.814 . . . . 55.439999999999998 112.216 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.4 m -105.38 101.13 10.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.863 0.363 . . . . 61.329999999999998 110.538 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.2 p -121.69 107.63 12.58 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.041 -0.527 . . . . 64.340000000000003 110.4 177.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -113.58 127.07 55.93 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.548 0.689 . . . . 73.219999999999999 111.505 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -157.04 93.75 1.36 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.889 -1.051 . . . . 72.230000000000004 108.699 175.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -148.8 154.68 39.88 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.367 -0.833 . . . . 60.409999999999997 110.33 -173.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.1 p-80 -156.39 143.12 18.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.826 0.346 . . . . 64.409999999999997 110.739 -177.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -139.82 91.19 2.45 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.944 -0.571 . . . . 71.400000000000006 109.487 177.451 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -142.0 109.05 5.47 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.047 0.451 . . . . 74.030000000000001 110.563 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.7 t -82.13 -175.78 5.82 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.697 -0.683 . . . . 70.319999999999993 109.376 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.8 m -81.15 78.54 7.94 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.055 0.455 . . . . 74.219999999999999 110.391 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -118.46 134.13 10.74 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.881 -0.675 . . . . 71.219999999999999 111.802 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 14' ' ' ARG . 30.6 ttt180 -164.41 125.54 2.17 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.829 0.347 . . . . 73.420000000000002 110.287 -179.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.319 -0.76 0 N-CA-C 109.411 -0.589 . . . . 63.539999999999999 109.411 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . 72.8 mt . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.552 0.215 . . . . 74.420000000000002 110.674 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.783 HH11 ' HG ' ' A' ' 77' ' ' LEU . 43.1 mtp180 -126.31 135.36 51.41 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.895 -0.409 . . . . 70.0 109.895 174.371 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.532 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.7 tt0 -68.77 110.47 4.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.04 -0.527 . . . . 74.209999999999994 109.711 177.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.5 tp -88.82 -52.18 5.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 111.131 -174.158 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.463 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 2.4 pt? -151.41 149.12 28.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.568 -0.287 . . . . 74.540000000000006 110.46 179.2 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -139.59 137.34 35.28 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.979 -0.378 . . . . 74.120000000000005 109.979 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.1 t -156.39 -175.7 5.57 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.143 -0.481 . . . . 73.530000000000001 109.973 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -106.78 -3.19 20.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.012 0.434 . . . . 71.109999999999999 110.614 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -107.28 134.75 49.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.959 -0.564 . . . . 74.310000000000002 111.252 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -93.76 -17.31 23.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.096 -0.502 . . . . 41.509999999999998 110.941 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t -65.24 -53.24 42.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-O 120.926 0.393 . . . . 74.019999999999996 110.451 -178.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.91 -34.48 78.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.189 -0.459 . . . . 74.010000000000005 110.732 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 66.7 mt -66.94 -32.03 73.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.447 -0.342 . . . . 51.399999999999999 111.032 179.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.9 m -67.52 -28.5 67.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.063 0.459 . . . . 74.150000000000006 110.333 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.87 -42.16 61.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.095 -0.502 . . . . 75.129999999999995 109.926 174.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.609 HG13 HD21 ' A' ' 84' ' ' LEU . 92.6 t -63.17 -45.35 98.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.646 -0.706 . . . . 61.100000000000001 110.721 176.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.47 -40.57 96.36 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.811 -0.632 . . . . 34.420000000000002 112.478 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.44 -33.43 74.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 72.439999999999998 111.184 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 87.2 mt -69.51 -51.28 37.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.147 0.498 . . . . 64.040000000000006 110.223 178.481 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.95 -47.19 81.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.699 -0.682 . . . . 70.25 110.815 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -66.65 -29.22 69.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 72.340000000000003 110.246 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.55 -28.56 73.11 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 121.094 -0.574 . . . . 65.430000000000007 112.32 178.137 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -96.45 11.8 33.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.852 0.358 . . . . 74.409999999999997 110.504 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.9 t70 66.86 19.64 10.64 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.561 -0.745 . . . . 74.049999999999997 110.89 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.9 mt -84.46 113.35 23.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.267 -0.424 . . . . 74.219999999999999 109.985 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.26 120.74 23.9 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 115.915 -0.584 . . . . 63.030000000000001 112.431 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -109.27 136.33 48.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.78 0.324 . . . . 75.439999999999998 110.841 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -94.38 94.77 8.46 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.007 -0.738 . . . . 62.229999999999997 109.007 176.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.419 HG22 HG22 ' A' ' 70' ' ' VAL . 20.7 t . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.728 -0.669 . . . . 62.32 110.17 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.458 -0.562 0 CA-C-O 120.974 0.323 . . . . 75.519999999999996 111.262 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.604 ' HA ' ' NE ' ' A' ' 68' ' ' ARG . 2.6 mmp_? -92.9 136.22 33.45 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.228 -0.442 . . . . 74.040000000000006 111.234 -176.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.1 ptt180 -145.02 144.99 31.31 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.753 -0.658 . . . . 70.340000000000003 111.0 -178.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.419 HG22 HG22 ' A' ' 51' ' ' VAL . 53.7 t -105.71 127.42 60.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.906 -0.588 . . . . 73.329999999999998 110.245 179.771 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.532 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 7.6 mp -113.27 137.78 50.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.153 -0.476 . . . . 70.230000000000004 110.337 178.207 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.7 m -104.8 160.78 5.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.051 -0.522 . . . . 63.340000000000003 110.572 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.426 ' HA ' HD23 ' A' ' 23' ' ' LEU . 78.7 m80 -84.47 40.81 0.8 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.512 -0.313 . . . . 75.319999999999993 111.585 -176.429 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 67.69 -173.2 0.19 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.806 -0.634 . . . . 63.509999999999998 112.401 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 27.2 t70 68.57 -70.76 0.13 Allowed 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 114.678 -1.146 . . . . 61.149999999999999 112.538 177.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.18 40.22 0.54 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.832 0.349 . . . . 71.219999999999999 111.746 -175.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.783 ' HG ' HH11 ' A' ' 24' ' ' ARG . 3.7 mm? -64.29 -49.98 69.69 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.737 -0.468 . . . . 63.32 109.737 175.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.72 -33.46 70.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.852 -0.613 . . . . 55.409999999999997 110.304 178.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.46 -52.48 48.81 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.891 -0.671 . . . . 71.239999999999995 112.138 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.42 86.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.472 0.177 . . . . 60.329999999999998 111.17 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -57.4 -48.82 78.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.487 -0.324 . . . . 64.010000000000005 111.352 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -67.51 -37.29 82.59 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 121.024 -0.27 . . . . 74.340000000000003 110.77 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 60.0 tp -60.62 -51.35 69.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.039 0.447 . . . . 73.109999999999999 110.52 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.609 HD21 HG13 ' A' ' 38' ' ' VAL . 10.5 mp -64.6 -33.79 76.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.907 -0.588 . . . . 72.129999999999995 111.326 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.824 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 95.3 m -66.92 -44.04 81.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.345 -0.389 . . . . 73.430000000000007 110.639 178.168 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -68.04 -35.29 78.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 71.219999999999999 110.136 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.57 -44.77 93.19 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.765 -0.652 . . . . 72.540000000000006 111.16 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 127.21 -14.78 6.52 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.228 -0.987 . . . . 70.030000000000001 113.602 175.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.511 HD11 ' HG ' ' A' ' 84' ' ' LEU . 1.6 pp -94.79 19.32 10.27 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.321 0.489 . . . . 64.310000000000002 112.321 -175.362 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.834 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -68.63 84.54 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.94 0.4 . . . . 74.319999999999993 110.51 176.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -145.77 -48.05 0.22 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.839 -0.618 . . . . 72.040000000000006 109.883 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -79.87 -7.63 58.83 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.021 0.439 . . . . 62.32 110.543 -179.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.834 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.1 mp -67.09 134.83 52.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.891 -0.595 . . . . 73.030000000000001 110.094 178.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 . . . . . 0 C--N 1.323 -0.551 0 CA-C-O 121.094 0.473 . . . . 54.240000000000002 110.869 -177.217 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 120.769 0.319 . . . . 62.32 110.337 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 95.25 89.69 1.74 Allowed Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.915 -0.659 . . . . 64.209999999999994 111.594 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.3 m -70.36 104.7 2.78 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.026 0.441 . . . . 73.340000000000003 110.733 -178.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 p -120.15 129.53 54.18 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 116.002 -0.544 . . . . 44.229999999999997 111.174 -177.394 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -147.48 20.62 1.19 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.635 -0.712 . . . . 72.329999999999998 109.677 174.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.9 m80 -109.53 116.94 32.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.042 -0.981 . . . . 72.310000000000002 110.744 179.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -132.66 116.76 17.05 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.844 -0.798 . . . . 72.010000000000005 108.844 170.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -142.86 126.44 16.87 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.871 -0.604 . . . . 72.400000000000006 111.091 -169.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -176.91 154.76 1.15 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.956 -0.565 . . . . 74.409999999999997 110.217 174.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -153.31 89.12 1.33 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.19 0.519 . . . . 62.340000000000003 109.682 175.318 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.3 p -75.07 143.27 43.53 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.771 -0.649 . . . . 72.140000000000001 111.091 -175.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.4 m -144.78 96.33 2.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 74.099999999999994 110.231 178.23 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -177.72 127.52 1.19 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 121.011 -0.614 . . . . 62.409999999999997 111.675 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -151.22 -31.12 0.17 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.915 0.388 . . . . 75.540000000000006 110.642 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.335 -0.393 . . . . 70.400000000000006 110.042 178.511 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 N--CA 1.453 -0.292 0 CA-C-O 120.912 0.387 . . . . 71.519999999999996 110.524 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.401 ' O ' ' HA ' ' A' ' 71' ' ' LEU . 66.9 mtt180 -113.66 144.42 42.94 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.705 -0.48 . . . . 72.140000000000001 109.705 175.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.531 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 80.3 tt0 -77.11 110.59 11.91 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.783 -1.191 . . . . 72.239999999999995 107.783 172.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.557 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -79.92 -52.62 7.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.941 -0.572 . . . . 62.539999999999999 110.075 -173.011 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.655 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 2.1 pt? -152.52 150.72 29.88 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.735 -0.666 . . . . 71.409999999999997 109.491 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.481 ' HD2' ' OE2' ' A' ' 25' ' ' GLU . 8.7 ptm85 -132.53 121.56 23.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.282 0.563 . . . . 72.230000000000004 110.206 176.106 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.8 t -119.25 168.87 10.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.507 -0.77 . . . . 73.129999999999995 110.625 -175.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -117.05 7.96 13.24 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.54 -0.541 . . . . 73.430000000000007 109.54 174.171 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -105.38 142.43 35.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.4 -0.818 . . . . 72.430000000000007 110.134 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.443 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -94.94 -24.4 16.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.453 -0.339 . . . . 74.340000000000003 111.63 -175.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.5 t -77.99 -36.37 21.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.142 0.496 . . . . 71.340000000000003 110.137 -176.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.6 tp -61.16 -34.61 75.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.589 -0.732 . . . . 75.310000000000002 110.304 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.74 HD11 ' HG3' ' A' ' 68' ' ' ARG . 87.7 mt -63.26 -35.45 80.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.88 -0.6 . . . . 64.230000000000004 110.885 178.548 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.0 m -68.29 -27.66 66.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.218 0.532 . . . . 62.32 110.632 178.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.18 -51.11 8.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.852 -0.613 . . . . 54.100000000000001 110.804 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.487 HG12 ' HA ' ' A' ' 35' ' ' LEU . 9.8 p -65.8 -34.26 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.25 -0.432 . . . . 52.119999999999997 110.514 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.21 -48.03 83.0 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 121.08 -0.581 . . . . 63.119999999999997 112.557 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.72 -25.26 67.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.107 0.48 . . . . 72.040000000000006 111.243 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.557 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.4 mt -75.6 -52.37 10.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.055 -0.52 . . . . 73.049999999999997 110.075 177.695 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.27 -49.15 75.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.748 -0.66 . . . . 74.310000000000002 111.104 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -63.6 -28.17 69.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.396 -0.365 . . . . 65.25 110.803 -178.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -73.44 -18.56 79.41 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.799 -0.715 . . . . 45.340000000000003 112.573 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -114.41 15.43 17.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.707 0.262 . . . . 63.43 111.707 -176.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.9 t70 71.45 7.35 6.01 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.426 0.631 . . . . 73.129999999999995 111.544 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 58.5 mt -70.96 112.09 5.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.169 -0.469 . . . . 74.409999999999997 111.01 -176.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -64.68 130.95 37.22 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.844 -0.616 . . . . 51.219999999999999 112.015 177.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 19.6 p80 -138.41 147.35 43.25 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.708 0.289 . . . . 72.129999999999995 110.769 -177.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 71' ' ' LEU . 77.3 mt -82.8 -65.92 0.95 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.092 -0.503 . . . . 70.430000000000007 110.996 176.486 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 54.5 t . . . . . 0 N--CA 1.466 0.372 0 CA-C-O 121.875 0.845 . . . . 63.32 110.602 -177.087 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo . . . . . 0 N--CA 1.465 -0.174 0 CA-C-O 120.799 0.25 . . . . 73.450000000000003 111.89 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.74 ' HG3' HD11 ' A' ' 35' ' ' LEU . 13.3 mmt85 -130.02 122.52 28.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.186 -0.301 . . . . 72.400000000000006 110.186 -177.705 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.721 ' HD3' HD11 ' A' ' 71' ' ' LEU . 1.8 ptp180 -112.66 136.44 52.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.196 0.522 . . . . 74.299999999999997 110.402 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 48.2 t -106.97 111.64 36.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.991 -0.55 . . . . 52.340000000000003 110.162 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.721 HD11 ' HD3' ' A' ' 69' ' ' ARG . 7.6 mp -104.62 139.78 38.97 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.34 -0.391 . . . . 75.409999999999997 110.253 177.683 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.8 m -130.27 168.68 22.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 O-C-N 123.73 0.644 . . . . 74.450000000000003 110.038 177.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 -82.38 163.22 21.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.292 -0.413 . . . . 63.340000000000003 110.83 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -59.45 -27.07 65.74 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.293 -0.412 . . . . 62.530000000000001 110.169 174.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -43.41 -59.12 2.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.218 -0.901 . . . . 74.5 111.781 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -116.79 35.42 4.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.181 -0.463 . . . . 74.340000000000003 110.31 -175.34 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.496 ' O ' ' HG3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -59.71 -53.89 52.69 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.363 -0.606 . . . . 73.120000000000005 109.363 178.675 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.48 -30.34 69.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.977 -0.556 . . . . 41.43 110.704 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.87 -49.32 49.36 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.802 -0.635 . . . . 62.32 112.389 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.75 -39.51 93.75 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.387 0.137 . . . . 62.399999999999999 110.71 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 77' ' ' LEU . 73.5 mtp180 -57.66 -47.92 80.94 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 110.088 -0.338 . . . . 72.430000000000007 110.088 175.407 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 82' ' ' ARG . 3.8 tpp180 -58.12 -50.9 71.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.79 -0.641 . . . . 73.219999999999999 110.494 178.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.557 HD21 ' HB3' ' A' ' 41' ' ' LEU . 55.7 tp -58.35 -52.18 66.69 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.529 -0.76 . . . . 75.209999999999994 111.856 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.98 -33.43 73.68 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.624 0.25 . . . . 73.420000000000002 111.643 -177.064 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.969 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 53.4 m -73.3 -36.67 66.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.1 0.476 . . . . 45.130000000000003 110.633 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -74.53 -32.79 62.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.83 -0.623 . . . . 71.430000000000007 110.3 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.57 96.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.776 -0.647 . . . . 72.5 111.807 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 150.94 -47.4 0.59 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 119.76 -1.21 . . . . 73.010000000000005 113.622 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.825 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -53.58 -75.77 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.7 0.25 . . . . 74.230000000000004 111.504 -175.014 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.969 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 42.2 38.89 1.24 Allowed 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.573 0.582 . . . . 53.229999999999997 112.573 178.568 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 29.5 t-80 -132.78 -46.44 0.87 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.385 0.612 . . . . 73.510000000000005 110.375 -176.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -71.09 -13.25 61.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.038 -0.983 . . . . 73.030000000000001 110.892 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.655 ' HA ' ' HB3' ' A' ' 27' ' ' LEU . 6.7 mp -66.13 96.0 0.31 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.881 -0.6 . . . . 72.450000000000003 110.131 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.043 -0.526 . . . . 63.240000000000002 110.577 -172.702 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttt . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.169 0.509 . . . . 71.109999999999999 110.109 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -174.97 54.71 0.13 Allowed Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 110.865 -0.894 . . . . 64.340000000000003 110.865 178.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.4 p -90.77 -4.52 56.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.49 -0.355 . . . . 73.549999999999997 111.888 -173.306 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.2 p -76.35 71.86 3.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.114 0.483 . . . . 74.310000000000002 112.238 -175.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -163.35 121.22 1.92 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.139 0.495 . . . . 75.299999999999997 111.49 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -118.56 -113.81 0.33 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 107.434 -1.321 . . . . 62.109999999999999 107.434 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 62.91 28.44 16.34 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.174 0.512 . . . . 63.030000000000001 111.815 166.692 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -114.48 105.39 13.05 Favored 'General case' 0 C--N 1.329 -0.31 0 O-C-N 121.699 -0.626 . . . . 65.349999999999994 111.558 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.4 p80 -160.81 126.63 3.9 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.917 -0.401 . . . . 60.439999999999998 109.917 170.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.4 t-160 -160.31 70.08 0.41 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.226 0.536 . . . . 70.340000000000003 109.689 178.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 p -99.38 101.36 12.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.738 -0.664 . . . . 54.329999999999998 110.607 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.6 m -152.2 86.27 1.29 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.334 -0.394 . . . . 45.210000000000001 110.558 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -132.6 37.27 2.05 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.858 -0.687 . . . . 61.240000000000002 111.938 179.119 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -101.97 36.0 2.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.082 0.468 . . . . 75.030000000000001 110.218 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 . . . . . 0 C--N 1.324 -0.515 0 CA-C-N 115.754 -0.657 . . . . 70.230000000000004 110.458 179.819 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.468 ' HB3' HD23 ' A' ' 71' ' ' LEU . 95.3 mt . . . . . 0 C--O 1.236 0.382 0 CA-C-O 121.033 0.444 . . . . 51.240000000000002 111.555 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 50.3 mmm-85 -106.09 132.99 51.51 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.722 -0.672 . . . . 74.040000000000006 109.87 177.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.544 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 22.3 tt0 -80.31 110.69 15.99 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.291 -0.633 . . . . 74.200000000000003 109.291 -179.359 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.671 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -84.62 -55.0 4.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.051 -0.522 . . . . 55.329999999999998 110.667 -172.597 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.782 ' HB3' HD23 ' A' ' 93' ' ' LEU . 1.2 pt? -142.59 153.99 44.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.14 -0.482 . . . . 72.329999999999998 110.689 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 28' ' ' ARG . 4.7 tmm_? -139.98 130.8 25.97 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.324 -0.853 . . . . 71.319999999999993 109.07 -178.78 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.0 t -167.11 175.5 7.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.118 -0.327 . . . . 60.439999999999998 110.118 178.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -119.53 4.07 11.17 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.368 -0.378 . . . . 64.319999999999993 110.202 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -85.6 108.27 17.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 54.130000000000003 110.353 -178.401 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.62 -35.91 81.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.728 -0.669 . . . . 75.430000000000007 111.52 -176.494 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 50.7 t -62.06 -51.95 66.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.911 0.386 . . . . 65.129999999999995 110.437 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.558 HD11 HD13 ' A' ' 89' ' ' LEU . 32.9 tp -64.45 -42.13 96.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.989 -0.55 . . . . 72.219999999999999 110.853 -179.341 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.404 HD13 ' HD2' ' A' ' 68' ' ' ARG . 62.1 mt -59.35 -38.95 81.69 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.778 0.323 . . . . 60.200000000000003 111.201 178.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 m -66.43 -38.72 88.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.918 0.39 . . . . 74.200000000000003 110.496 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.58 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.29 -46.52 80.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 60.219999999999999 110.288 177.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.555 HG13 HD21 ' A' ' 84' ' ' LEU . 95.5 t -59.59 -43.54 91.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 65.420000000000002 110.751 178.441 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.22 -43.68 97.01 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.985 -0.626 . . . . 74.219999999999999 111.918 178.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.47 -36.08 82.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.721 0.296 . . . . 50.43 110.886 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 94.2 mt -65.35 -52.29 54.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.004 0.431 . . . . 63.520000000000003 110.395 178.357 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.0 mt -64.53 -36.73 85.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.808 -0.633 . . . . 75.239999999999995 110.859 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -65.1 -39.96 93.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.029 -0.532 . . . . 72.109999999999999 110.305 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.61 -21.43 74.67 Favored Glycine 0 CA--C 1.518 0.239 0 CA-C-N 115.804 -0.635 . . . . 73.349999999999994 112.876 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -101.63 0.66 36.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.957 0.408 . . . . 65.430000000000007 110.338 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 t70 59.59 30.09 19.7 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.27 -0.877 . . . . 74.219999999999999 111.253 178.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 65.2 mt -79.67 114.83 21.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-N 115.962 -0.563 . . . . 72.319999999999993 110.158 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.21 110.87 2.71 Favored Glycine 0 N--CA 1.453 -0.195 0 CA-C-N 116.06 -0.518 . . . . 60.399999999999999 112.183 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 54.2 p-80 -131.36 137.86 48.92 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.71 0.29 . . . . 73.120000000000005 110.808 -175.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 92.8 mt -112.63 146.55 38.42 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.665 -0.495 . . . . 73.540000000000006 109.665 177.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.441 HG12 ' HA ' ' A' ' 70' ' ' VAL . 16.7 m . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 116.486 -0.325 . . . . 74.109999999999999 110.452 -176.49 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo . . . . . 0 C--O 1.234 0.32 0 CA-C-O 121.243 0.434 . . . . 52.409999999999997 111.656 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.404 ' HD2' HD13 ' A' ' 35' ' ' LEU . 40.3 ttm180 -105.58 112.48 25.58 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.647 -0.706 . . . . 74.510000000000005 110.212 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.415 ' HG3' ' OE1' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -115.39 158.97 21.7 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.007 -0.542 . . . . 62.509999999999998 109.842 176.799 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.441 ' HA ' HG12 ' A' ' 51' ' ' VAL . 21.4 t -109.24 118.09 55.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.406 -0.361 . . . . 74.239999999999995 110.747 -175.324 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.544 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.3 mp -107.88 132.49 53.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.206 -0.452 . . . . 71.420000000000002 109.794 177.194 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.3 m -92.77 142.86 12.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 120.878 0.37 . . . . 43.509999999999998 110.738 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -88.18 61.2 6.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 74.230000000000004 110.477 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 55.85 -169.25 0.09 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.215 -0.902 . . . . 64.439999999999998 112.217 178.054 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.4 t70 64.32 -72.59 0.06 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.924 0.889 . . . . 65.109999999999999 112.328 177.273 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.608 ' OD1' ' HA3' ' A' ' 79' ' ' GLY . 0.4 OUTLIER -88.93 36.53 0.81 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.187 0.517 . . . . 73.019999999999996 110.577 -175.473 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.39 -51.18 70.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.617 -0.719 . . . . 75.310000000000002 110.419 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.41 -27.72 62.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.714 -0.675 . . . . 63.32 110.244 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.608 ' HA3' ' OD1' ' A' ' 76' ' ' ASP . . . -61.67 -52.87 47.94 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.649 -0.705 . . . . 60.009999999999998 112.424 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.96 97.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.629 0.252 . . . . 71.439999999999998 111.088 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 81.4 mtp180 -59.16 -41.85 89.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.094 0.473 . . . . 64.209999999999994 110.63 178.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.464 ' HA ' ' HE ' ' A' ' 82' ' ' ARG . 0.3 OUTLIER -68.89 -49.62 56.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.621 -0.718 . . . . 61.119999999999997 110.809 179.545 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 49.6 tp -56.27 -48.99 75.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.519 -0.764 . . . . 74.510000000000005 112.074 -173.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.555 HD21 HG13 ' A' ' 38' ' ' VAL . 11.1 mp -67.66 -27.37 66.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.651 -0.249 . . . . 74.019999999999996 111.211 -178.602 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.762 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.2 m -70.97 -43.48 67.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.396 -0.365 . . . . 74.239999999999995 110.264 175.114 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -62.77 -39.79 95.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.999 -0.546 . . . . 72.099999999999994 110.764 176.49 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.86 -43.47 85.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.801 -0.636 . . . . 75.409999999999997 111.465 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 140.08 -43.37 1.14 Allowed Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 119.939 -1.124 . . . . 73.200000000000003 113.433 176.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.873 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -58.93 -75.94 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.654 0.242 . . . . 74.219999999999999 111.654 -175.299 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.873 ' H ' ' HG ' ' A' ' 89' ' ' LEU . . . 44.69 44.46 7.49 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 122.772 0.429 . . . . 54.420000000000002 111.548 -177.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -116.55 -56.02 2.32 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.893 -0.323 . . . . 74.239999999999995 111.467 -173.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -76.81 10.25 2.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.299 -0.41 . . . . 73.120000000000005 111.235 -177.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.782 HD23 ' HB3' ' A' ' 27' ' ' LEU . 63.2 mt -80.52 117.8 21.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.433 . . . . 70.129999999999995 110.273 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 . . . . . 0 C--N 1.319 -0.757 0 N-CA-C 109.226 -0.657 . . . . 73.219999999999999 109.226 177.03 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttp . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.76 0.314 . . . . 62.240000000000002 110.542 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.24 86.59 1.86 Allowed Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.8 -0.714 . . . . 72.099999999999994 111.707 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.1 m -116.06 118.56 33.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.779 0.323 . . . . 51.329999999999998 110.844 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.6 m -104.39 114.07 28.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.638 -0.504 . . . . 43.329999999999998 109.638 176.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -137.84 105.78 5.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.238 0.542 . . . . 73.420000000000002 111.624 -176.206 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -142.99 95.0 2.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.45 -0.795 . . . . 73.310000000000002 109.802 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -75.14 149.52 39.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.467 -0.788 . . . . 75.519999999999996 110.904 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -167.91 128.94 1.41 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.218 0.532 . . . . 73.310000000000002 111.061 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.5 p-80 -145.22 75.92 1.46 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.795 0.807 . . . . 71.420000000000002 109.754 175.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -81.54 87.59 6.23 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.737 -0.665 . . . . 65.439999999999998 111.571 -171.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.1 m -130.67 123.57 29.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.851 -0.796 . . . . 72.25 108.851 173.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.3 t -135.92 104.31 5.68 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.484 0.55 . . . . 72.409999999999997 112.484 -175.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 72.37 -167.53 53.23 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.285 -0.871 . . . . 75.120000000000005 114.917 167.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -172.99 -176.62 1.44 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.508 -0.846 . . . . 65.530000000000001 108.981 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 . . . . . 0 C--N 1.325 -0.491 0 N-CA-C 110.354 -0.239 . . . . 75.329999999999998 110.354 177.475 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.553 HD22 HD12 ' A' ' 50' ' ' LEU . 5.8 mp . . . . . 0 CA--C 1.519 -0.226 0 N-CA-C 109.85 -0.426 . . . . 75.030000000000001 109.85 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -122.06 169.27 11.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.299 -0.41 . . . . 75.109999999999999 110.218 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -67.89 120.72 14.64 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.28 -0.418 . . . . 63.340000000000003 111.384 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.634 HD12 HD22 ' A' ' 27' ' ' LEU . 1.8 tm? -74.62 -36.41 62.94 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 107.254 -1.388 . . . . 54.310000000000002 107.254 169.392 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.634 HD22 HD12 ' A' ' 26' ' ' LEU . 2.5 pt? -176.81 159.99 1.84 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.186 -0.915 . . . . 71.540000000000006 110.195 -175.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.447 ' NH1' ' HB3' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -110.07 112.02 23.74 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.081 -1.081 . . . . 74.439999999999998 108.081 170.125 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.686 HG22 ' H ' ' A' ' 32' ' ' ALA . 11.2 m -85.13 109.22 18.11 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.104 -0.498 . . . . 73.310000000000002 111.237 -171.834 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.447 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.6 OUTLIER -90.51 -15.04 31.49 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.125 -0.694 . . . . 74.340000000000003 109.125 176.569 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -73.14 -32.48 64.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.12 -0.945 . . . . 71.430000000000007 110.873 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.686 ' H ' HG22 ' A' ' 29' ' ' THR . . . 74.25 -40.27 0.45 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.703 0.801 . . . . 73.299999999999997 112.586 178.282 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.1 t -78.91 -39.99 22.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.051 0.453 . . . . 75.319999999999993 110.805 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.404 ' O ' HG23 ' A' ' 38' ' ' VAL . 55.5 tp -52.79 -39.84 62.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.681 -0.691 . . . . 63.119999999999997 112.266 -178.015 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 4.5 pp -65.23 -25.2 67.58 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 111.651 0.241 . . . . 73.019999999999996 111.651 -175.312 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.1 m -70.67 -34.03 71.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.099 0.476 . . . . 74.040000000000006 109.958 178.215 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.33 -40.91 50.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.974 -0.557 . . . . 73.25 110.044 176.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.425 HG13 HD21 ' A' ' 84' ' ' LEU . 75.1 t -57.24 -36.34 51.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 115.606 -0.725 . . . . 73.140000000000001 110.799 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.99 -46.03 95.41 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.596 -0.729 . . . . 70.439999999999998 112.433 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.34 -26.6 65.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.913 0.387 . . . . 62.200000000000003 111.201 -179.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.32 -52.12 13.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.395 -0.366 . . . . 74.230000000000004 110.977 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.539 HD23 HD23 ' A' ' 83' ' ' LEU . 63.7 mt -69.45 -39.45 77.76 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.218 -0.446 . . . . 75.239999999999995 111.401 -175.053 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -30.54 60.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.586 -0.279 . . . . 60.219999999999999 111.117 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.51 -26.67 73.6 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.038 -0.601 . . . . 63.009999999999998 111.796 177.612 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.45 5.58 46.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.597 0.237 . . . . 53.210000000000001 110.876 178.451 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.1 t70 70.61 7.68 6.3 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.84 -0.618 . . . . 74.030000000000001 111.217 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.0 mt -75.2 -45.36 41.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.254 0.549 . . . . 63.119999999999997 110.696 -178.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.01 148.21 23.86 Favored Glycine 0 C--N 1.315 -0.588 0 CA-C-N 115.285 -0.871 . . . . 50.229999999999997 111.854 -179.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -142.66 139.78 31.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.291 -0.263 . . . . 70.530000000000001 110.291 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.553 HD12 HD22 ' A' ' 23' ' ' LEU . 71.0 mt -119.02 106.73 12.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.826 0.346 . . . . 72.409999999999997 110.469 175.574 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.599 HG22 HG22 ' A' ' 70' ' ' VAL . 59.0 t . . . . . 0 C--N 1.325 -0.498 0 N-CA-C 109.046 -0.724 . . . . 75.349999999999994 109.046 174.565 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 N--CA 1.46 -0.448 0 CA-C-O 121.194 0.414 . . . . 75.340000000000003 111.464 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -72.58 133.55 44.77 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.707 -0.679 . . . . 64.109999999999999 110.223 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 57.2 mtt85 -113.97 135.1 54.37 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.999 -0.546 . . . . 72.329999999999998 111.765 -171.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.599 HG22 HG22 ' A' ' 51' ' ' VAL . 45.0 t -101.98 116.55 45.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.913 -0.585 . . . . 73.209999999999994 109.666 177.047 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mp -101.95 142.98 32.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.793 0.33 . . . . 53.340000000000003 110.546 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.447 HG23 ' HB2' ' A' ' 26' ' ' LEU . 3.0 t -126.29 154.25 35.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.9 -0.591 . . . . 45.109999999999999 109.882 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -59.14 139.06 57.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.99 -0.55 . . . . 73.540000000000006 109.637 174.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.411 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 38.1 mt-10 -57.53 156.43 8.16 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.969 -0.292 . . . . 71.129999999999995 110.387 178.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.411 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 28.7 t70 73.05 -47.5 0.67 Allowed 'General case' 0 N--CA 1.468 0.471 0 O-C-N 123.935 0.772 . . . . 54.530000000000001 110.376 -173.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -73.85 -16.13 61.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.787 -0.82 . . . . 64.439999999999998 108.787 175.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.425 HD22 HD23 ' A' ' 26' ' ' LEU . 1.1 tm? -55.57 -45.83 77.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.524 -1.216 . . . . 72.209999999999994 109.659 174.584 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.06 -38.16 89.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 71.329999999999998 110.987 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.62 -44.41 82.13 Favored Glycine 0 C--N 1.329 0.181 0 C-N-CA 120.971 -0.633 . . . . 61.43 111.829 177.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.408 ' O ' ' HG ' ' A' ' 84' ' ' LEU . . . -59.54 -39.78 85.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.77 0.319 . . . . 14.43 110.683 177.281 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.4 mtp180 -55.35 -52.91 61.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.89 -0.596 . . . . 75.329999999999998 110.947 176.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -62.3 -43.49 98.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 75.329999999999998 110.754 -177.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.539 HD23 HD23 ' A' ' 42' ' ' LEU . 50.1 tp -59.28 -47.11 86.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.641 -0.708 . . . . 74.450000000000003 111.035 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.425 HD21 HG13 ' A' ' 38' ' ' VAL . 66.4 mt -72.01 -26.11 62.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.073 -0.512 . . . . 75.340000000000003 111.588 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 56.4 m -68.0 -48.3 66.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.584 -0.28 . . . . 75.040000000000006 110.423 176.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -65.64 -42.09 91.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.86 0.362 . . . . 73.439999999999998 110.698 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -119.42 82.21 1.84 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.099 0.476 . . . . 71.329999999999998 111.136 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 154.3 -95.69 0.15 Allowed Glycine 0 N--CA 1.44 -1.091 0 N-CA-C 111.384 -0.686 . . . . 34.130000000000003 111.384 178.1 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.559 HD12 ' N ' ' A' ' 90' ' ' ALA . 1.7 pp 175.12 -35.28 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.763 0.425 . . . . 62.520000000000003 110.662 -177.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ALA . . . . . 0.559 ' N ' HD12 ' A' ' 89' ' ' LEU . . . 48.39 54.12 10.9 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.707 -0.679 . . . . 61.299999999999997 112.185 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -99.8 -34.64 10.07 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.642 0.258 . . . . 74.150000000000006 110.879 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -82.09 24.44 0.65 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.344 -0.389 . . . . 64.549999999999997 111.786 -175.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.405 HD21 ' HB1' ' A' ' 90' ' ' ALA . 94.2 mt -50.09 117.51 2.38 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.372 0.42 . . . . 71.310000000000002 111.83 -175.084 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.409 ' N ' ' HA ' ' A' ' 27' ' ' LEU . 79.2 mtt180 . . . . . 0 N--CA 1.466 0.346 0 O-C-N 124.048 0.842 . . . . 74.329999999999998 110.947 -172.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.0 mtp . . . . . 0 N--CA 1.478 0.968 0 CA-C-O 120.714 0.293 . . . . 72.530000000000001 110.531 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 117.64 90.02 1.42 Allowed Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.821 -0.704 . . . . 50.350000000000001 111.968 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.6 p -66.61 158.08 30.81 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.884 0.374 . . . . 75.530000000000001 110.78 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 m -76.2 97.49 4.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.936 0.398 . . . . 74.319999999999993 110.722 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -90.33 93.64 9.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 53.530000000000001 109.899 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -123.02 99.27 6.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.181 -0.463 . . . . 72.510000000000005 110.11 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 74.9 m-70 -110.49 169.41 8.76 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.067 -0.716 . . . . 73.420000000000002 109.067 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -153.56 130.83 11.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.262 0.554 . . . . 73.25 111.097 178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -142.99 113.12 7.17 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.445 -0.798 . . . . 45.32 109.101 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -103.68 112.03 24.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.035 0.445 . . . . 73.310000000000002 110.652 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.1 m -150.65 117.94 6.02 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.714 -0.676 . . . . 62.530000000000001 110.406 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -134.68 88.7 2.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.078 -0.51 . . . . 64.439999999999998 109.928 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -131.67 58.0 0.71 Allowed Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 111.373 -0.691 . . . . 40.310000000000002 111.373 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.89 76.3 8.71 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.638 -0.504 . . . . 71.299999999999997 109.638 -176.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -97.66 -11.3 23.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.89 -0.595 . . . . 74.099999999999994 110.736 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -71.58 104.78 3.41 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.553 -0.536 . . . . 71.409999999999997 109.553 175.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 83.4 mt -100.19 1.51 42.04 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.132 -0.486 . . . . 75.340000000000003 111.246 -175.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.406 ' O ' ' HB2' ' A' ' 19' ' ' PHE . 47.2 m-85 -129.39 -159.69 0.98 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.557 0.217 . . . . 64.230000000000004 110.759 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.406 ' HB2' ' O ' ' A' ' 18' ' ' TYR . 66.6 m-85 73.97 75.88 0.12 Allowed 'General case' 0 C--O 1.234 0.286 0 O-C-N 124.055 0.847 . . . . 75.430000000000007 111.84 176.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -91.91 93.5 8.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.448 -0.796 . . . . 64.430000000000007 109.666 171.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -176.75 -134.87 2.05 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 110.891 -0.883 . . . . 51.420000000000002 110.891 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER 177.67 -51.24 0.01 OUTLIER 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.848 0.324 . . . . 70.349999999999994 111.18 178.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.7 mt -134.82 143.38 47.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.028 0.442 . . . . 65.209999999999994 111.649 -175.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.891 ' HB2' HD21 ' A' ' 77' ' ' LEU . 50.7 mtt180 -134.4 148.03 50.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.974 -0.557 . . . . 72.439999999999998 109.729 173.022 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.84 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 25.1 tt0 -81.94 136.58 35.29 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.038 -0.528 . . . . 70.109999999999999 110.701 -177.11 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.676 HD11 HG22 ' A' ' 72' ' ' VAL . 11.2 mp -106.77 -65.86 1.06 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.634 0.254 . . . . 63.329999999999998 111.521 -179.12 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -147.0 177.21 9.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.733 0.301 . . . . 74.140000000000001 110.925 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' HB ' ' A' ' 29' ' ' THR . 6.2 ptp180 -148.46 154.28 39.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.319 -0.4 . . . . 73.109999999999999 110.223 -178.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.461 HG21 HD23 ' A' ' 34' ' ' LEU . 12.2 t 178.29 163.61 0.7 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.377 0.423 . . . . 74.239999999999995 110.121 176.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -113.95 -0.17 14.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.009 0.433 . . . . 74.430000000000007 109.834 175.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -73.77 116.51 14.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.755 -0.657 . . . . 72.129999999999995 110.576 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.56 -33.8 74.48 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.55 -0.75 . . . . 54.210000000000001 112.239 -176.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 65.7 t -72.34 -47.53 52.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.818 0.342 . . . . 72.049999999999997 110.25 -178.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.461 HD23 HG21 ' A' ' 29' ' ' THR . 40.2 tp -61.38 -40.83 95.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 75.129999999999995 110.426 178.17 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.581 HD13 ' HD2' ' A' ' 68' ' ' ARG . 69.9 mt -65.26 -29.17 69.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.959 -0.564 . . . . 72.549999999999997 111.356 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.1 m -76.05 -39.08 56.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.715 0.293 . . . . 62.530000000000001 110.528 177.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.457 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -64.43 -53.89 41.33 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.194 -0.457 . . . . 70.219999999999999 110.935 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.8 t -60.53 -38.25 77.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.066 -0.515 . . . . 63.5 110.884 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.55 -48.39 82.14 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.897 -0.592 . . . . 70.299999999999997 111.918 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.63 -34.66 77.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.714 0.293 . . . . 62.109999999999999 111.629 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 96.2 mt -64.6 -51.48 62.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.14 -0.482 . . . . 75.030000000000001 110.639 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.13 -41.36 74.02 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.93 -0.577 . . . . 74.109999999999999 110.984 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.74 -39.44 91.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.899 -0.591 . . . . 74.120000000000005 110.821 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.0 -25.04 71.95 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.122 -0.561 . . . . 72.109999999999999 112.822 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -102.05 7.98 41.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.542 0.211 . . . . 70.129999999999995 111.412 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.8 t70 61.41 30.55 18.98 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.539 0.685 . . . . 74.140000000000001 110.903 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.59 HG21 ' HB2' ' A' ' 80' ' ' ALA . 72.0 mt -85.13 121.18 36.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.298 -0.41 . . . . 62.0 110.347 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -62.63 107.98 1.89 Allowed Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.5 -0.64 . . . . 64.400000000000006 111.5 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' VAL . 52.1 p-80 -126.72 166.65 16.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.91 0.386 . . . . 61.310000000000002 111.48 -173.194 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.5 tp -138.58 104.61 5.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.347 -0.842 . . . . 71.120000000000005 109.676 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.595 HG12 HG22 ' A' ' 70' ' ' VAL . 29.5 m -110.89 2.35 8.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.506 0.669 . . . . 62.140000000000001 110.141 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 32.2 tp -97.15 82.36 3.17 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.174 -0.921 . . . . 73.219999999999999 110.732 -173.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.489 ' HB2' ' HG2' ' A' ' 69' ' ' ARG . 34.8 t70 -82.6 -65.83 0.96 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.38 -0.97 . . . . 62.450000000000003 108.38 172.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -139.3 150.0 44.9 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.227 -1.027 . . . . 73.349999999999994 108.227 167.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -130.58 118.89 21.7 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.199 0.523 . . . . 72.299999999999997 111.088 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.465 ' HB2' HG13 ' A' ' 66' ' ' ILE . 28.0 ttt -76.41 147.28 38.1 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.624 -0.716 . . . . 63.310000000000002 109.61 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.8 m -60.55 151.79 27.78 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.996 0.427 . . . . 71.099999999999994 111.321 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.433 ' O ' HG13 ' A' ' 58' ' ' ILE . 11.2 tp -75.05 3.77 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-N 115.885 -0.598 . . . . 74.299999999999997 111.744 -173.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.31 84.08 6.72 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.053 -0.721 . . . . 73.310000000000002 109.053 177.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 50.58 93.56 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.808 0.843 . . . . 65.230000000000004 112.099 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -66.52 160.62 46.79 Favored Glycine 0 N--CA 1.452 -0.289 0 CA-C-N 115.681 -0.691 . . . . 73.030000000000001 112.958 -177.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.7 p -80.95 -174.72 4.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.971 0.415 . . . . 71.420000000000002 111.153 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.62 -38.02 15.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.37 -0.377 . . . . 55.329999999999998 110.69 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -169.92 43.42 0.2 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 119.951 -1.119 . . . . 52.109999999999999 113.126 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 97.4 t -89.44 -34.87 7.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.236 0.541 . . . . 44.310000000000002 110.697 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.465 HG13 ' HB2' ' A' ' 56' ' ' MET . 50.2 mm -117.85 98.27 51.46 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.976 -0.556 . . . . 71.219999999999999 111.023 -177.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -91.99 140.66 2.34 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.172 2.581 . . . . 71.239999999999995 112.08 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.581 ' HD2' HD13 ' A' ' 35' ' ' LEU . 66.3 mtt180 -104.39 160.61 14.77 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.121 -0.326 . . . . 71.439999999999998 110.121 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.489 ' HG2' ' HB2' ' A' ' 53' ' ' ASP . 17.8 ptt180 -133.68 140.8 47.27 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.64 -0.504 . . . . 72.129999999999995 109.64 176.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.595 HG22 HG12 ' A' ' 51' ' ' VAL . 48.5 t -103.63 116.38 47.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.907 -0.588 . . . . 60.0 111.253 -173.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.84 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.4 mp -117.84 162.14 18.59 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.107 -0.701 . . . . 75.019999999999996 109.107 173.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.676 HG22 HD11 ' A' ' 26' ' ' LEU . 35.2 m -137.34 167.41 23.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 120.824 0.345 . . . . 53.140000000000001 110.104 174.406 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -73.13 137.55 45.24 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.223 -0.658 . . . . 63.219999999999999 109.223 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.816 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 40.9 mt-10 -65.26 -11.15 38.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.657 0.265 . . . . 72.200000000000003 111.584 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -55.59 -39.25 70.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.605 0.717 . . . . 75.200000000000003 110.009 171.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -129.43 33.81 4.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.338 -0.846 . . . . 70.129999999999995 110.215 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.891 HD21 ' HB2' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -56.52 -57.08 13.9 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.656 -0.702 . . . . 64.129999999999995 110.415 -177.67 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.49 70.36 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.841 -0.618 . . . . 61.25 110.996 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -68.97 -46.77 58.24 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 121.183 -0.532 . . . . 73.140000000000001 112.659 -178.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.59 ' HB2' HG21 ' A' ' 47' ' ' ILE . . . -63.58 -44.4 94.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.739 0.304 . . . . 63.530000000000001 110.862 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 57.2 mtp85 -67.39 -33.32 74.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.443 . . . . 73.230000000000004 110.401 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -62.01 -47.29 85.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.829 -0.623 . . . . 73.329999999999998 109.788 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.5 tp -60.37 -53.19 60.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 75.329999999999998 110.981 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.47 -28.81 68.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.12 -0.491 . . . . 62.219999999999999 112.001 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.768 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 47.4 m -85.26 -48.66 8.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.812 0.339 . . . . 71.349999999999994 111.213 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -74.19 -43.88 55.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.223 -0.444 . . . . 72.230000000000004 111.9 -173.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.54 29.99 4.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.853 0.359 . . . . 64.129999999999995 111.662 -174.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -121.35 -80.0 0.56 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.182 -1.009 . . . . 65.540000000000006 112.306 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.47 HD12 ' N ' ' A' ' 90' ' ' ALA . 1.8 pp -167.58 -44.5 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.873 -0.163 . . . . 75.319999999999993 111.273 -177.004 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.768 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 55.96 94.67 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.724 0.64 . . . . 70.239999999999995 111.704 -178.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -157.64 -64.96 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.523 -0.471 . . . . 72.120000000000005 111.234 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -87.52 16.87 5.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.211 -0.45 . . . . 74.450000000000003 111.824 -172.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 98.8 mt -73.72 126.17 29.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.131 0.491 . . . . 71.530000000000001 111.615 -175.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -117.02 166.64 11.96 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.468 -0.787 . . . . 61.030000000000001 109.152 178.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.7 p -106.82 175.16 5.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.551 0.215 . . . . 73.239999999999995 111.167 -177.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -83.92 72.5 10.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 122.112 0.958 . . . . 54.32 109.265 171.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 0.99 0 CA-C-N 114.918 -1.037 . . . . 51.149999999999999 111.281 -175.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.7 ttp . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 110.176 -0.305 . . . . 74.450000000000003 110.176 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.62 119.24 2.63 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.684 -0.769 . . . . 63.399999999999999 111.993 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.3 t -139.12 97.81 3.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.155 0.502 . . . . 72.25 109.693 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 t -89.78 85.47 6.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.331 -0.618 . . . . 52.43 109.331 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 9.8 p-80 -131.51 70.77 1.46 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.558 0.694 . . . . 74.420000000000002 110.291 -177.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -125.93 87.54 2.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.641 0.734 . . . . 70.310000000000002 110.828 -178.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.6 p-80 -126.03 37.91 4.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.754 -0.657 . . . . 75.319999999999993 109.848 176.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -70.91 77.94 0.64 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.7 -0.852 . . . . 73.219999999999999 108.7 175.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 37.7 t-80 -122.19 107.85 12.63 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.408 -0.814 . . . . 71.5 109.694 -173.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -130.28 95.43 3.9 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.561 -0.533 . . . . 62.450000000000003 109.561 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.6 t -129.49 113.97 15.54 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.169 -0.469 . . . . 62.130000000000003 109.775 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.2 t -151.3 112.19 4.27 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.183 -0.462 . . . . 61.329999999999998 110.266 178.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 84.38 65.26 1.53 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.908 -0.663 . . . . 63.43 112.7 177.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.42 ' HD2' ' OD1' ' A' ' 76' ' ' ASP . 51.2 ttp85 -77.25 94.91 4.21 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.869 -0.789 . . . . 74.299999999999997 108.869 177.005 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -84.86 95.32 8.97 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.214 -0.448 . . . . 72.329999999999998 112.021 -171.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.2 p30 176.47 143.47 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.073 -0.967 . . . . 63.43 109.437 171.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 95.8 mt -124.96 22.08 8.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.883 0.373 . . . . 55.43 110.501 178.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.646 ' O ' ' HA ' ' A' ' 75' ' ' ASP . 60.5 m-85 -91.77 149.47 21.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.951 -0.568 . . . . 43.549999999999997 111.398 -177.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.2 p90 -176.31 156.09 1.56 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.576 -0.898 . . . . 55.329999999999998 108.576 176.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -171.92 -65.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.046 0.388 . . . . 71.219999999999999 112.046 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.46 -114.56 1.45 Allowed Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.821 -0.704 . . . . 74.209999999999994 113.754 -168.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -141.66 -77.28 0.28 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.062 0.458 . . . . 75.310000000000002 110.672 -173.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.627 HD13 HD22 ' A' ' 50' ' ' LEU . 14.1 mt -151.86 132.26 13.76 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 73.299999999999997 110.084 -176.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.623 ' HB2' HD21 ' A' ' 77' ' ' LEU . 17.5 mmt180 -113.84 133.38 55.45 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.228 -0.442 . . . . 73.439999999999998 110.419 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.663 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 29.6 tt0 -64.83 109.06 1.94 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.721 -0.844 . . . . 71.030000000000001 108.721 175.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.7 tp -87.16 -54.81 4.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.425 -0.352 . . . . 74.099999999999994 110.811 -172.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.58 157.06 43.21 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.282 -0.417 . . . . 73.109999999999999 110.102 177.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.428 ' HG3' ' HB3' ' A' ' 69' ' ' ARG . 39.9 ttp180 -142.73 119.95 11.51 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.628 -0.508 . . . . 72.400000000000006 109.628 179.502 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -148.91 160.55 43.16 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.107 -0.331 . . . . 64.109999999999999 110.107 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -107.56 10.28 29.26 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.395 -0.366 . . . . 71.349999999999994 110.531 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -92.51 107.51 19.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.382 -0.372 . . . . 72.150000000000006 110.066 177.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.98 -27.15 68.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.953 -0.567 . . . . 72.219999999999999 111.896 -175.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 44.2 t -66.85 -50.91 60.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.861 0.362 . . . . 73.340000000000003 110.477 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.716 HD11 HD22 ' A' ' 89' ' ' LEU . 23.1 tp -64.27 -38.68 91.91 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.979 -0.555 . . . . 63.509999999999998 110.323 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.458 HD13 ' HD2' ' A' ' 68' ' ' ARG . 77.7 mt -61.25 -32.9 72.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.96 -0.564 . . . . 62.039999999999999 111.047 177.131 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -70.02 -39.27 75.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.905 0.383 . . . . 61.119999999999997 110.559 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.508 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.19 -52.8 52.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 73.129999999999995 110.459 178.008 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.522 HG13 HD21 ' A' ' 84' ' ' LEU . 86.3 t -60.12 -40.36 83.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.895 -0.593 . . . . 72.010000000000005 110.428 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 43' ' ' ASP . . . -61.7 -49.32 77.56 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.601 -0.727 . . . . 54.149999999999999 112.264 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.37 -31.53 72.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.699 0.285 . . . . 73.120000000000005 111.295 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.701 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.7 mt -64.61 -51.75 61.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.219 -0.446 . . . . 74.400000000000006 110.702 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.1 mt -71.94 -40.05 68.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.104 -0.498 . . . . 45.420000000000002 110.832 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 39' ' ' GLY . 0.8 OUTLIER -66.5 -35.98 81.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.125 0.488 . . . . 71.219999999999999 110.35 -177.379 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -73.14 -35.51 57.24 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.855 -0.688 . . . . 63.109999999999999 112.378 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.15 -1.0 57.02 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.501 0.185 . . . . 73.340000000000003 111.501 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.4 t70 71.24 28.16 3.07 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.753 0.658 . . . . 55.530000000000001 110.857 177.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -84.02 128.31 38.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.167 -0.47 . . . . 73.439999999999998 110.193 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.81 110.82 3.7 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.064 -0.588 . . . . 65.239999999999995 111.978 -177.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -109.21 130.85 55.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.013 0.435 . . . . 74.140000000000001 111.436 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.627 HD22 HD13 ' A' ' 23' ' ' LEU . 60.8 tp -98.39 102.8 14.65 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.89 -0.782 . . . . 75.439999999999998 108.89 171.424 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.451 HG12 HG22 ' A' ' 70' ' ' VAL . 6.4 m -127.23 162.0 33.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.127 -0.488 . . . . 74.400000000000006 110.553 -175.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.9 tt 68.06 102.05 0.05 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 124.122 0.889 . . . . 72.219999999999999 110.311 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -111.98 92.05 3.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.022 -0.536 . . . . 75.150000000000006 110.856 -177.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -177.02 169.01 2.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.483 -0.781 . . . . 75.519999999999996 109.604 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -98.77 132.48 44.1 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.636 -0.257 . . . . 62.219999999999999 110.356 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.1 mmt -67.57 104.48 1.6 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.23 0.538 . . . . 72.239999999999995 110.852 178.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.8 t -123.48 162.98 21.78 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.615 -0.72 . . . . 72.329999999999998 109.985 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.4 tp -76.66 -18.54 14.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.419 0.628 . . . . 63.450000000000003 109.454 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.442 HD22 ' HA ' ' A' ' 59' ' ' LEU . 1.6 tm? -75.27 106.78 6.97 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.638 -0.875 . . . . 70.150000000000006 108.638 176.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -56.86 -50.15 73.31 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.937 -0.574 . . . . 73.420000000000002 111.01 -175.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 173.97 155.8 12.55 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 121.026 -0.607 . . . . 73.230000000000004 111.894 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.7 p -113.64 -39.73 3.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.759 0.314 . . . . 62.439999999999998 110.173 177.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.5 tp -173.09 119.64 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.075 -0.511 . . . . 72.319999999999993 110.081 177.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 146.09 166.49 12.07 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.677 -0.773 . . . . 43.340000000000003 112.383 176.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 37.7 t -109.93 -26.42 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 109.717 -0.475 . . . . 72.209999999999994 109.717 177.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 47.9 mm 69.09 91.03 0.08 OUTLIER Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 115.106 -0.952 . . . . 53.109999999999999 110.633 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -69.24 99.98 0.73 Allowed 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 122.731 2.287 . . . . 70.109999999999999 111.092 178.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.458 ' HD2' HD13 ' A' ' 35' ' ' LEU . 27.7 ttm180 -66.8 122.69 18.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.036 -0.529 . . . . 73.25 110.289 -177.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.428 ' HB3' ' HG3' ' A' ' 28' ' ' ARG . 19.3 ptt180 -113.27 152.12 30.23 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.727 -0.669 . . . . 75.450000000000003 110.449 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.451 HG22 HG12 ' A' ' 51' ' ' VAL . 29.8 t -112.98 117.51 55.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.683 -0.689 . . . . 74.209999999999994 110.104 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.663 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 7.5 mp -107.86 137.7 45.4 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.013 -0.365 . . . . 71.150000000000006 110.013 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.487 HG23 HD22 ' A' ' 77' ' ' LEU . 14.5 m -132.39 166.07 30.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.143 -0.48 . . . . 61.109999999999999 110.338 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -76.07 156.56 33.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.434 -0.348 . . . . 74.010000000000005 110.451 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.638 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 57.7 mp0 -59.97 -21.89 61.8 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.324 -0.398 . . . . 73.450000000000003 110.908 174.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.646 ' HA ' ' O ' ' A' ' 18' ' ' TYR . 1.4 m-20 -52.19 -71.41 0.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.854 -0.612 . . . . 74.400000000000006 110.737 176.081 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.42 ' OD1' ' HD2' ' A' ' 14' ' ' ARG . 44.5 m-20 -91.38 18.0 7.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.657 -0.701 . . . . 64.329999999999998 110.653 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.638 ' HB2' ' HA ' ' A' ' 74' ' ' GLU . 0.3 OUTLIER -56.87 -51.18 70.07 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.559 -0.534 . . . . 70.510000000000005 109.559 179.242 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.59 -32.48 72.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.602 -0.727 . . . . 62.130000000000003 110.991 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.42 -45.96 43.94 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.069 -0.586 . . . . 74.430000000000007 112.334 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.6 -40.21 95.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.59 0.233 . . . . 54.240000000000002 110.558 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -59.13 -45.03 91.99 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.847 0.356 . . . . 62.509999999999998 110.132 175.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.47 -50.9 72.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.779 -0.646 . . . . 74.099999999999994 110.553 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.701 HD21 ' HB3' ' A' ' 41' ' ' LEU . 55.8 tp -58.61 -52.96 63.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.772 -0.649 . . . . 71.230000000000004 111.257 -177.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.522 HD21 HG13 ' A' ' 38' ' ' VAL . 85.6 mt -66.54 -28.26 68.4 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.226 -0.443 . . . . 72.319999999999993 111.944 -177.482 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.863 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 90.6 m -82.45 -50.18 9.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.826 0.346 . . . . 64.450000000000003 111.14 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -72.93 -44.13 61.56 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.338 0.495 . . . . 75.310000000000002 112.338 -173.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -121.76 7.26 9.93 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.827 0.677 . . . . 73.209999999999994 112.827 -172.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -111.41 -74.96 0.76 Allowed Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 119.915 -1.136 . . . . 71.310000000000002 112.288 -178.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.716 HD22 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -172.61 -51.89 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.526 0.203 . . . . 74.299999999999997 111.203 -172.357 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.863 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 59.2 82.98 0.14 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.905 -0.589 . . . . 54.43 110.74 -172.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -158.79 -44.59 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.03 0.443 . . . . 74.109999999999999 110.796 -176.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -89.91 11.11 21.35 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.071 -0.513 . . . . 71.120000000000005 110.819 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 90.9 mt -71.17 133.0 45.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 63.109999999999999 110.911 -176.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 95' ' ' SER . 3.4 tpt180 -116.79 -60.36 1.86 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.798 -0.637 . . . . 73.510000000000005 110.679 178.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.441 ' O ' ' HG3' ' A' ' 94' ' ' ARG . 19.4 m 64.3 -167.19 0.22 Allowed 'General case' 0 CA--C 1.535 0.387 0 O-C-N 123.372 0.42 . . . . 51.229999999999997 110.287 -176.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 97' ' ' ASP . 15.4 p-10 -73.6 -53.08 11.33 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.594 -0.521 . . . . 74.349999999999994 109.594 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.429 ' HB2' ' O ' ' A' ' 96' ' ' ASP . 19.0 t70 . . . . . 0 C--O 1.251 1.157 0 O-C-N 124.131 0.894 . . . . 74.140000000000001 109.09 171.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.835 0.35 . . . . 53.109999999999999 110.207 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 81.3 -172.4 53.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.751 -0.738 . . . . 52.420000000000002 111.783 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.0 p -141.08 148.28 39.92 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.005 0.402 . . . . 72.439999999999998 110.784 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.2 p -87.0 133.19 33.6 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.041 -0.527 . . . . 71.120000000000005 110.563 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -124.34 116.26 22.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.512 0.672 . . . . 71.540000000000006 111.231 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -145.33 106.57 4.19 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.289 -0.869 . . . . 63.549999999999997 109.715 175.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -127.75 107.25 9.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.488 -0.324 . . . . 73.230000000000004 111.26 -176.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -144.27 146.45 32.64 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.401 -0.592 . . . . 71.010000000000005 109.401 172.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -156.02 118.42 4.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.131 0.491 . . . . 73.450000000000003 111.673 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -145.45 94.17 2.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.74 0.781 . . . . 62.399999999999999 109.923 168.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.1 t -130.65 102.18 6.01 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.356 -0.838 . . . . 64.219999999999999 109.493 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.7 t -149.35 155.34 40.35 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.485 -0.561 . . . . 64.230000000000004 109.485 -176.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 158.97 99.1 0.15 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.909 -0.663 . . . . 74.030000000000001 111.881 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -95.24 -26.91 15.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.917 0.389 . . . . 75.019999999999996 110.487 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -85.02 96.01 9.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.222 0.534 . . . . 72.239999999999995 110.326 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -144.14 168.78 19.22 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.178 -0.919 . . . . 73.450000000000003 108.951 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.8 mt -111.85 108.95 18.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.885 0.374 . . . . 63.020000000000003 110.885 -179.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -87.25 -28.52 22.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.268 -0.423 . . . . 72.010000000000005 110.284 175.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -69.09 157.8 36.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.026 -0.534 . . . . 65.540000000000006 110.96 -177.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -123.98 124.88 43.55 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.316 -0.402 . . . . 74.200000000000003 110.718 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -118.59 -167.6 13.97 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.57 -0.612 . . . . 54.530000000000001 111.57 176.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.447 ' O ' ' HB2' ' A' ' 74' ' ' GLU . 52.5 m80 -135.32 178.11 7.29 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.993 -0.373 . . . . 73.040000000000006 109.993 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 73' ' ' HIS . 8.5 mp -80.62 129.28 34.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.057 -0.72 . . . . 62.509999999999998 109.057 174.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -105.3 142.52 34.93 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.407 -0.361 . . . . 73.140000000000001 110.229 -177.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.785 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 28.9 tt0 -76.12 109.07 9.48 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.472 -0.936 . . . . 75.329999999999998 108.472 176.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.422 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -81.82 -70.17 0.56 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.131 -0.486 . . . . 75.400000000000006 112.04 -169.9 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.499 ' HB2' ' O ' ' A' ' 92' ' ' GLU . 0.9 OUTLIER -142.38 170.28 15.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.192 0.52 . . . . 74.340000000000003 112.225 -169.645 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.564 ' O ' ' HB3' ' A' ' 92' ' ' GLU . 6.4 ptp180 -138.34 158.04 45.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.881 -1.054 . . . . 73.530000000000001 109.0 177.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.8 t -161.21 163.03 31.4 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.05 -0.352 . . . . 62.32 110.05 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -116.02 11.41 15.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.141 -0.481 . . . . 75.129999999999995 110.363 -174.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.401 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 28.4 t70 -120.41 135.51 55.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.168 -0.469 . . . . 72.109999999999999 111.223 -177.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.21 -31.78 64.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.82 -0.627 . . . . 65.430000000000007 111.522 -176.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.4 t -69.87 -43.43 79.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.621 -0.511 . . . . 71.450000000000003 109.621 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.401 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 9.2 mp -58.84 -48.35 81.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.571 -0.741 . . . . 72.109999999999999 110.846 175.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.6 mt -52.79 -41.72 64.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.929 -0.578 . . . . 75.299999999999997 111.381 175.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.9 m -72.71 -41.63 65.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.226 -0.443 . . . . 65.409999999999997 111.092 -178.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -64.05 -54.22 37.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.481 -0.327 . . . . 51.119999999999997 110.649 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.696 HG13 HD22 ' A' ' 84' ' ' LEU . 87.8 t -61.02 -40.46 85.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.147 0.499 . . . . 75.319999999999993 110.607 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.17 -52.04 50.43 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 115.702 -0.681 . . . . 71.019999999999996 112.528 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.33 -31.8 67.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.671 0.272 . . . . 61.219999999999999 111.485 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 94.2 mt -63.15 -51.24 67.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.334 -0.394 . . . . 61.350000000000001 110.341 177.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.4 mt -68.25 -36.8 80.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.836 -0.62 . . . . 73.439999999999998 110.652 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -64.4 -46.84 81.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 71.010000000000005 110.53 177.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.47 -36.97 93.25 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.794 -0.639 . . . . 62.509999999999998 112.93 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.97 -10.72 59.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.012 0.434 . . . . 74.519999999999996 110.81 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.4 t70 70.32 23.71 4.96 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 115.061 -0.972 . . . . 63.210000000000001 110.635 178.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.9 mt -74.32 -39.34 48.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.701 -0.682 . . . . 71.140000000000001 109.485 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.19 110.68 0.33 Allowed Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 114.928 -1.033 . . . . 70.209999999999994 112.077 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -91.71 150.79 20.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.826 0.346 . . . . 60.509999999999998 110.884 -177.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.4 tp -114.09 87.31 2.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.785 -0.82 . . . . 71.129999999999995 108.785 170.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.694 HG12 HG22 ' A' ' 70' ' ' VAL . 6.3 m -96.49 56.32 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.521 0.677 . . . . 62.009999999999998 110.892 -176.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 97.6 mt -116.35 133.67 55.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.4 -0.818 . . . . 71.319999999999993 110.295 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -144.3 -64.47 0.36 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.507 -0.553 . . . . 64.439999999999998 109.507 174.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -157.42 133.72 9.67 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.993 -0.743 . . . . 75.530000000000001 108.993 175.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -83.14 140.96 32.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.823 0.344 . . . . 71.140000000000001 110.368 -177.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -76.43 134.02 39.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.264 -0.425 . . . . 74.010000000000005 110.455 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.5 m -83.9 135.9 34.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.349 -0.387 . . . . 61.219999999999999 110.508 177.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.6 tt -82.97 94.0 3.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.689 0.757 . . . . 71.219999999999999 110.481 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 57.0 tp -136.22 121.13 18.68 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.395 -0.82 . . . . 64.340000000000003 109.947 -179.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 57.46 43.78 22.41 Favored 'General case' 0 C--O 1.235 0.295 0 O-C-N 123.758 0.661 . . . . 61.229999999999997 110.973 -178.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 116.26 -105.95 1.44 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.792 -0.64 . . . . 72.25 112.078 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.4 t -170.25 56.83 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.195 0.521 . . . . 34.130000000000003 109.825 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.0 mp -108.37 104.29 13.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.238 -0.437 . . . . 64.209999999999994 110.692 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -139.0 98.07 0.24 Allowed Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.531 -0.628 . . . . 64.219999999999999 111.531 177.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 23.8 t -82.0 77.63 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.335 0.588 . . . . 75.019999999999996 110.833 -176.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.6 mp -128.4 117.92 20.16 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.338 -0.846 . . . . 70.319999999999993 109.335 174.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -71.95 113.91 3.81 Favored 'Trans proline' 0 C--O 1.234 0.321 0 C-N-CA 122.778 2.319 . . . . 74.400000000000006 111.854 178.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -69.0 139.81 55.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.321 -0.4 . . . . 74.230000000000004 110.222 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 63.2 mtt180 -114.1 155.22 26.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.198 -0.455 . . . . 74.299999999999997 110.275 -176.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.694 HG22 HG12 ' A' ' 51' ' ' VAL . 31.6 t -113.02 120.83 64.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.254 -0.43 . . . . 72.420000000000002 110.356 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.785 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.8 mp -114.89 143.52 45.0 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.609 0.242 . . . . 64.239999999999995 110.826 177.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.0 m -142.35 160.84 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 116.179 -0.464 . . . . 74.230000000000004 110.112 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.519 ' HA ' ' HA ' ' A' ' 23' ' ' LEU . 2.0 p-80 -72.48 143.3 48.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.149 0.499 . . . . 74.310000000000002 111.255 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.898 ' HA ' HD23 ' A' ' 77' ' ' LEU . 31.1 tt0 -57.1 -37.01 71.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.056 -0.974 . . . . 63.229999999999997 113.059 -169.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -64.17 -18.95 64.96 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.33 0.492 . . . . 63.020000000000003 112.33 -171.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -117.12 15.22 15.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.019 0.438 . . . . 73.129999999999995 110.869 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.898 HD23 ' HA ' ' A' ' 74' ' ' GLU . 0.6 OUTLIER -58.96 -41.12 86.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.744 -0.662 . . . . 54.43 110.451 177.383 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.07 -40.33 80.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.913 -0.585 . . . . 75.219999999999999 111.187 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.91 -47.3 25.73 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.58 -0.819 . . . . 61.130000000000003 112.268 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.462 ' O ' ' HG ' ' A' ' 84' ' ' LEU . . . -63.07 -41.82 99.53 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.717 0.266 . . . . 65.549999999999997 111.717 -177.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -58.84 -47.75 83.76 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 120.574 0.226 . . . . 75.510000000000005 110.887 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -56.52 -45.15 81.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.2 0.524 . . . . 75.120000000000005 110.372 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 45.1 tp -64.9 -52.04 58.64 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.474 -0.785 . . . . 74.430000000000007 111.256 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.696 HD22 HG13 ' A' ' 38' ' ' VAL . 76.2 mt -70.41 -28.05 64.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.114 -0.494 . . . . 73.450000000000003 111.883 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.902 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.8 m -75.5 -49.49 18.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.645 0.26 . . . . 53.329999999999998 110.755 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -75.34 -44.15 46.81 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.042 0.386 . . . . 71.519999999999996 112.042 -174.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -115.04 20.15 15.24 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.152 0.427 . . . . 73.340000000000003 112.152 -173.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -125.84 -80.51 0.38 Allowed Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 120.176 -1.011 . . . . 73.219999999999999 111.527 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.618 HD12 ' N ' ' A' ' 90' ' ' ALA . 0.9 OUTLIER 176.77 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.763 0.425 . . . . 73.340000000000003 111.302 -176.827 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.902 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 65.12 7.05 3.83 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.165 0.802 . . . . 75.129999999999995 113.165 177.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -85.49 -33.95 21.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.923 0.392 . . . . 64.400000000000006 110.941 -177.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.564 ' HB3' ' O ' ' A' ' 28' ' ' ARG . 5.7 mm-40 -80.85 1.17 31.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.716 -0.674 . . . . 75.219999999999999 111.161 -174.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 83.7 mt -66.6 115.37 6.38 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.232 -0.44 . . . . 65.540000000000006 111.62 -174.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.422 ' H ' ' HA ' ' A' ' 27' ' ' LEU . 22.3 ttt180 72.05 -58.22 0.59 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 114.916 -1.038 . . . . 75.349999999999994 111.879 177.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 63.7 p -126.9 167.81 15.34 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.96 0.41 . . . . 65.219999999999999 110.87 -178.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -96.96 19.3 12.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.642 0.734 . . . . 74.530000000000001 109.608 176.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 30.8 t70 . . . . . 0 C--O 1.246 0.883 0 CA-C-N 115.25 -0.886 . . . . 75.129999999999995 110.658 -176.021 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 120.768 0.318 . . . . 70.120000000000005 110.46 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.12 113.89 0.31 Allowed Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.028 -0.606 . . . . 21.440000000000001 111.824 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.4 m -108.18 152.75 24.15 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.418 -0.586 . . . . 62.420000000000002 109.418 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.5 m -77.08 85.93 3.57 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.183 0.516 . . . . 64.120000000000005 110.103 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -89.43 73.42 7.89 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.668 0.747 . . . . 73.230000000000004 110.022 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -145.72 145.16 30.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.262 -0.881 . . . . 75.540000000000006 109.792 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -131.04 114.92 15.78 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.975 -0.557 . . . . 63.450000000000003 109.837 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -79.14 144.73 34.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.863 0.363 . . . . 72.219999999999999 110.527 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -159.53 122.58 3.6 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.459 -0.571 . . . . 63.109999999999999 109.459 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -117.67 114.31 23.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.078 0.466 . . . . 75.109999999999999 110.361 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.9 m -152.52 85.8 1.26 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.616 -0.72 . . . . 62.530000000000001 109.676 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.9 t -162.81 150.85 13.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.768 -0.651 . . . . 33.009999999999998 109.56 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 149.66 149.99 5.14 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.821 -0.704 . . . . 64.030000000000001 112.11 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 70.1 mtp180 -134.92 -175.52 3.93 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.626 0.25 . . . . 75.439999999999998 110.334 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -127.45 101.61 6.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.029 -0.532 . . . . 64.340000000000003 109.944 175.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -76.9 90.52 3.52 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.614 -0.884 . . . . 72.230000000000004 108.614 176.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -101.12 100.55 11.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.091 -0.504 . . . . 74.400000000000006 110.367 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -150.99 81.97 1.33 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.257 -0.883 . . . . 70.219999999999999 109.057 175.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -98.95 115.55 29.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.457 -0.792 . . . . 53.109999999999999 109.401 179.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -149.48 137.17 20.25 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.301 -0.629 . . . . 75.040000000000006 109.301 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -130.34 42.19 1.44 Allowed Glycine 0 C--N 1.329 0.162 0 C-N-CA 120.04 -1.076 . . . . 72.120000000000005 113.89 -170.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 20.9 m170 -106.7 172.69 6.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.908 0.385 . . . . 72.510000000000005 110.607 173.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.1 mp -117.2 142.77 46.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.041 -0.527 . . . . 75.230000000000004 110.285 -178.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.46 ' HB2' HD21 ' A' ' 77' ' ' LEU . 28.4 mmm-85 -133.35 133.84 43.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.039 -0.528 . . . . 74.310000000000002 110.149 -176.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.588 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 71.8 tt0 -68.59 114.74 7.24 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.529 -0.545 . . . . 63.329999999999998 109.529 173.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.508 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -84.72 -54.7 4.53 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.705 -0.48 . . . . 74.319999999999993 109.705 -175.89 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.571 HD11 HG21 ' A' ' 38' ' ' VAL . 2.1 pt? -148.27 160.7 42.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.149 0.5 . . . . 55.140000000000001 110.956 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.499 ' HG3' ' HG2' ' A' ' 69' ' ' ARG . 51.6 ttt180 -141.23 122.7 15.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.469 -0.787 . . . . 71.129999999999995 109.58 -178.117 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 t -150.26 177.81 9.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.675 0.274 . . . . 74.530000000000001 110.296 -177.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -124.67 -4.03 7.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.126 -0.488 . . . . 71.519999999999996 110.903 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -85.49 125.12 32.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.939 0.4 . . . . 75.219999999999999 110.769 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.6 -41.07 80.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.628 -0.715 . . . . 74.549999999999997 111.677 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.2 t -63.36 -43.26 98.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-O 121.277 0.561 . . . . 73.329999999999998 110.819 -176.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.53 ' CD2' ' HG3' ' A' ' 92' ' ' GLU . 47.6 tp -62.3 -44.46 96.47 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.791 -0.64 . . . . 53.439999999999998 110.798 178.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 68.2 mt -59.41 -39.56 83.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 75.150000000000006 111.266 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.7 m -62.47 -38.72 90.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.837 0.351 . . . . 64.120000000000005 110.958 178.355 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.455 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -66.83 -48.72 68.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 63.25 110.634 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.571 HG21 HD11 ' A' ' 27' ' ' LEU . 60.4 t -61.32 -39.92 84.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.971 -0.559 . . . . 51.409999999999997 110.6 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.64 -45.59 95.4 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.109 -0.567 . . . . 64.420000000000002 112.46 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.63 -28.98 69.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.904 0.383 . . . . 71.439999999999998 111.388 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 93.3 mt -73.6 -51.47 16.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.141 -0.481 . . . . 63.049999999999997 110.333 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.0 mt -66.66 -39.36 88.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.784 -0.644 . . . . 70.530000000000001 111.11 -176.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -70.18 -36.87 74.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.779 0.323 . . . . 72.310000000000002 110.784 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.45 -32.26 78.7 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.689 -0.767 . . . . 73.450000000000003 112.526 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.06 11.78 26.43 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.504 0.192 . . . . 72.040000000000006 111.466 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.7 t70 59.26 30.15 19.84 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 122.016 0.912 . . . . 70.030000000000001 110.812 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 60.3 mt -83.97 -44.7 18.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.685 -0.688 . . . . 72.010000000000005 109.791 178.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.1 139.34 5.85 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.036 -0.983 . . . . 71.349999999999994 111.253 -175.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -123.75 117.14 24.26 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.101 0.477 . . . . 71.120000000000005 110.628 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.8 mt -101.71 96.51 7.14 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.781 -0.451 . . . . 74.319999999999993 109.781 176.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.7 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 30.6 m -101.41 -38.79 6.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.097 -0.501 . . . . 64.540000000000006 110.228 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.704 ' HG ' ' HB2' ' A' ' 54' ' ' GLN . 29.8 tp 64.56 119.42 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 O-C-N 124.35 1.031 . . . . 75.409999999999997 111.935 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.542 ' HA ' ' HE ' ' A' ' 68' ' ' ARG . 30.7 t70 -60.55 -58.24 9.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.703 . . . . 61.149999999999999 109.66 175.216 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' HB2' ' HG ' ' A' ' 52' ' ' LEU . 32.3 tt0 42.66 59.49 2.76 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.221 0.951 . . . . 75.209999999999994 111.94 175.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -85.57 76.16 10.05 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.33 0.586 . . . . 64.400000000000006 109.43 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 89.2 mtp -91.9 -54.12 3.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.389 -0.823 . . . . 74.340000000000003 109.984 -178.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.8 m -84.87 76.34 10.25 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.796 -0.638 . . . . 54.009999999999998 109.806 177.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 4.3 tp -77.36 92.39 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-O 121.797 0.808 . . . . 71.010000000000005 109.833 178.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.443 ' O ' ' HA2' ' A' ' 64' ' ' GLY . 1.7 tm? -131.93 104.02 6.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.95 -1.023 . . . . 73.209999999999994 108.895 178.005 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.33 -77.5 0.08 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.562 -0.744 . . . . 75.0 110.927 -177.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.34 -76.95 0.47 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.82 -0.705 . . . . 23.52 112.213 -176.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 36.5 m -124.23 -50.68 1.78 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.222 0.534 . . . . 72.140000000000001 110.303 176.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -121.26 -36.88 3.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.997 -0.547 . . . . 61.399999999999999 111.426 -175.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.443 ' HA2' ' O ' ' A' ' 59' ' ' LEU . . . 83.78 71.91 1.3 Allowed Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 109.951 -1.259 . . . . 73.319999999999993 109.951 -169.127 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.4 t -83.24 95.06 3.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.126 0.489 . . . . 71.530000000000001 112.18 -169.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.6 mp -104.73 99.57 19.19 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.636 -0.876 . . . . 62.509999999999998 108.636 168.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -71.76 106.67 2.03 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.765 2.31 . . . . 75.329999999999998 111.941 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.542 ' HE ' ' HA ' ' A' ' 53' ' ' ASP . 81.5 mtt85 -87.72 133.43 33.85 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.563 -0.532 . . . . 70.099999999999994 109.563 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.7 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 60.1 mtp180 -120.03 137.94 53.8 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.779 -0.646 . . . . 45.25 109.722 -169.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.668 HG22 HG12 ' A' ' 51' ' ' VAL . 8.1 t -99.95 105.94 18.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.823 0.344 . . . . 72.310000000000002 110.728 -171.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.588 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 9.1 mp -104.2 127.7 51.84 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.126 -0.488 . . . . 54.009999999999998 110.58 177.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 29.7 m -109.56 -176.04 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.602 -0.726 . . . . 72.239999999999995 109.648 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -107.22 162.37 13.94 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.938 -0.305 . . . . 63.140000000000001 110.267 -179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -59.48 -22.73 62.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.407 0.622 . . . . 75.200000000000003 109.978 173.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -50.25 -36.18 30.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.477 -1.238 . . . . 51.420000000000002 112.684 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -141.49 30.59 1.72 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.853 0.358 . . . . 72.109999999999999 110.605 -175.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.46 HD21 ' HB2' ' A' ' 24' ' ' ARG . 0.2 OUTLIER -57.95 -47.4 83.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.05 0.453 . . . . 65.5 110.593 -177.081 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.29 -40.49 74.23 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.003 -0.544 . . . . 74.049999999999997 111.129 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -66.39 -48.21 65.19 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.903 -0.665 . . . . 74.239999999999995 112.157 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.71 -41.2 77.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.764 0.316 . . . . 71.450000000000003 110.815 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -59.12 -53.98 52.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.353 -0.385 . . . . 72.239999999999995 111.078 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -64.73 -38.21 90.2 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 121.175 -0.21 . . . . 71.409999999999997 111.265 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.3 tp -58.69 -47.98 82.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.077 0.465 . . . . 72.239999999999995 110.708 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.582 ' HG ' HD11 ' A' ' 89' ' ' LEU . 11.1 mp -72.89 -28.67 62.62 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.056 -0.52 . . . . 73.400000000000006 111.213 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.688 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 89.5 m -66.36 -46.14 77.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 110.358 -0.238 . . . . 31.34 110.358 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.62 -31.74 72.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.274 -0.421 . . . . 73.409999999999997 110.72 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.96 -27.06 67.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.067 0.461 . . . . 24.219999999999999 111.115 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.73 -15.83 59.27 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.801 -0.714 . . . . 73.109999999999999 112.493 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.582 HD11 ' HG ' ' A' ' 84' ' ' LEU . 3.2 pp -84.55 9.42 13.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.766 0.317 . . . . 73.200000000000003 111.366 -177.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.688 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . -65.65 86.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.131 0.491 . . . . 65.230000000000004 110.039 174.457 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -163.77 -37.23 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.4 -0.818 . . . . 71.109999999999999 110.009 -177.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.53 ' HG3' ' CD2' ' A' ' 34' ' ' LEU . 20.8 mm-40 -80.44 4.13 19.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.319 -0.401 . . . . 62.119999999999997 110.91 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.454 ' CD1' ' HA ' ' A' ' 90' ' ' ALA . 10.2 mp -65.61 142.85 57.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.058 -0.519 . . . . 61.109999999999999 111.16 -177.44 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -118.52 71.6 0.85 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.935 -0.575 . . . . 73.439999999999998 110.008 177.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.1 p -81.8 31.29 0.36 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.58 -0.736 . . . . 71.430000000000007 111.299 -176.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -88.36 7.35 32.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.054 -0.521 . . . . 74.140000000000001 110.587 -176.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.459 -0.781 . . . . 44.32 109.754 177.536 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 120.979 0.418 . . . . 74.409999999999997 110.34 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -119.74 42.47 1.75 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.444 -0.884 . . . . 60.530000000000001 112.107 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.0 m -140.19 91.17 2.43 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.068 0.461 . . . . 62.25 109.81 178.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 m -129.04 93.63 3.64 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.825 -0.625 . . . . 73.310000000000002 110.607 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -133.56 88.36 2.47 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.128 -0.487 . . . . 71.129999999999995 111.09 176.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -113.59 118.47 34.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.759 -0.655 . . . . 71.439999999999998 109.477 173.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -158.77 113.16 2.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.258 -0.428 . . . . 75.319999999999993 110.201 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -141.52 127.05 18.9 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.778 -0.647 . . . . 71.150000000000006 109.847 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -170.74 82.79 0.09 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.208 -0.451 . . . . 62.219999999999999 110.036 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -150.87 93.2 1.91 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.394 -0.366 . . . . 60.229999999999997 111.029 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.2 m -156.59 94.65 1.49 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.974 -0.557 . . . . 74.549999999999997 109.593 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.0 m -148.0 126.8 12.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.809 0.299 . . . . 54.219999999999999 111.809 -177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 92.69 130.4 5.31 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.119 -0.562 . . . . 55.32 114.189 170.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.72 157.27 37.8 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.231 -0.655 . . . . 74.150000000000006 109.231 170.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -129.41 119.53 23.97 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.072 0.463 . . . . 70.340000000000003 111.386 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -161.26 109.5 1.53 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.635 -0.712 . . . . 72.510000000000005 110.463 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.1 mt -85.41 105.67 16.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.992 0.425 . . . . 61.140000000000001 110.279 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -82.53 152.33 26.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.854 -0.612 . . . . 73.409999999999997 110.638 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -160.83 127.21 4.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.382 -0.372 . . . . 71.120000000000005 110.834 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.451 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 6.1 mm-40 -150.97 146.95 26.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.097 -0.501 . . . . 53.43 110.138 175.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 174.16 80.16 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.762 -0.733 . . . . 72.430000000000007 112.284 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.462 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 55.9 t-80 -164.28 149.1 10.01 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.85 -0.426 . . . . 74.530000000000001 109.85 -178.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mp -124.96 144.26 50.46 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.83 -0.433 . . . . 72.340000000000003 109.83 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -115.71 148.74 39.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.622 0.249 . . . . 65.239999999999995 111.263 -176.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.933 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.8 tt0 -84.13 121.4 27.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.957 -0.565 . . . . 62.420000000000002 110.51 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.436 ' CD1' HG22 ' A' ' 72' ' ' VAL . 9.8 mp -100.6 -66.21 0.92 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.803 0.668 . . . . 75.239999999999995 112.803 -173.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.619 ' CB ' ' HA ' ' A' ' 93' ' ' LEU . 2.4 pt? -142.25 169.22 18.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.18 0.514 . . . . 73.019999999999996 111.934 -171.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -100.87 136.19 41.11 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.089 -0.96 . . . . 73.010000000000005 109.443 176.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.8 p -117.74 92.32 3.81 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.539 0.685 . . . . 70.430000000000007 111.172 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 16.9 p-10 -111.54 9.53 21.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.817 0.818 . . . . 74.0 109.352 175.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.482 ' HB3' ' HB3' ' A' ' 34' ' ' LEU . 18.1 t70 -114.03 125.53 54.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.83 -1.077 . . . . 53.329999999999998 109.799 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.24 -44.02 97.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.19 -0.459 . . . . 73.439999999999998 111.602 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 46.9 t -70.76 -44.58 76.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.309 -0.405 . . . . 54.409999999999997 110.668 -176.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.602 HD22 ' HG3' ' A' ' 92' ' ' GLU . 29.2 tp -58.65 -42.74 89.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.969 -0.56 . . . . 71.209999999999994 111.204 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 64.8 tp -62.49 -35.79 80.48 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.176 -0.465 . . . . 62.439999999999998 110.875 -177.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.2 m -70.55 -42.38 71.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 54.240000000000002 110.648 176.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.72 -54.1 31.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 55.210000000000001 111.537 -177.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.491 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 87.1 t -62.7 -41.07 90.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.997 0.427 . . . . 64.340000000000003 110.662 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.36 -34.33 89.62 Favored Glycine 0 N--CA 1.453 -0.196 0 CA-C-N 115.784 -0.644 . . . . 64.420000000000002 112.489 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.57 -36.28 68.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 55.520000000000003 110.779 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 87.2 mt -65.74 -46.3 79.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.996 -0.547 . . . . 65.430000000000007 110.501 178.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 38' ' ' VAL . 85.7 mt -59.02 -47.77 84.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.577 -0.738 . . . . 64.349999999999994 110.559 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -68.56 -37.51 79.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.131 -0.486 . . . . 73.230000000000004 110.856 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.1 -20.76 67.36 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 115.788 -0.642 . . . . 50.130000000000003 113.182 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -109.68 7.97 24.6 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.802 -0.234 . . . . 75.430000000000007 111.218 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.7 t70 61.07 33.99 19.33 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.748 0.785 . . . . 72.239999999999995 110.665 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.928 HG23 ' HB3' ' A' ' 76' ' ' ASP . 84.8 mt -82.41 120.25 33.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.521 -0.763 . . . . 62.030000000000001 110.321 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.68 109.45 2.91 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.927 -0.654 . . . . 71.420000000000002 111.747 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -126.39 148.14 49.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.976 0.417 . . . . 72.310000000000002 111.065 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 65.5 tp -127.99 127.98 44.2 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.774 -0.648 . . . . 65.219999999999999 109.579 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.3 m -102.77 126.32 57.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.989 0.423 . . . . 74.219999999999999 110.948 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.836 HD23 HD13 ' A' ' 71' ' ' LEU . 4.0 mm? -102.82 114.46 28.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.915 -0.584 . . . . 52.350000000000001 109.61 176.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -86.62 -64.31 1.17 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.418 -0.355 . . . . 54.25 110.764 -176.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 68.07 120.86 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 O-C-N 124.125 0.89 . . . . 61.350000000000001 112.384 178.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -114.55 167.03 11.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.761 -0.654 . . . . 61.240000000000002 109.838 173.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.22 153.96 42.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.8 0.333 . . . . 72.010000000000005 111.486 -175.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.0 m -59.98 157.21 13.12 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.879 -0.6 . . . . 71.400000000000006 111.034 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.57 ' O ' ' HB2' ' A' ' 59' ' ' LEU . 5.4 tp -72.58 96.23 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-O 121.272 0.558 . . . . 65.129999999999995 111.535 -177.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.57 ' HB2' ' O ' ' A' ' 58' ' ' ILE . 0.5 OUTLIER 167.31 97.73 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.128 -1.064 . . . . 62.020000000000003 108.128 177.068 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 64.88 92.33 0.07 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.552 0.691 . . . . 62.329999999999998 110.533 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -114.1 46.48 1.16 Allowed Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.743 -0.741 . . . . 43.520000000000003 113.196 -176.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.8 p -83.47 -54.75 4.74 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.011 0.434 . . . . 42.039999999999999 110.33 174.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.2 mp -110.77 134.53 52.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.179 -0.464 . . . . 75.349999999999994 110.503 178.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -134.62 -67.05 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.436 -0.666 . . . . 73.439999999999998 111.436 176.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.5 t 59.95 64.66 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-O 121.64 0.733 . . . . 73.019999999999996 110.363 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.8 mp -103.86 111.17 65.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.516 -0.765 . . . . 52.119999999999997 109.282 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.89 114.82 3.3 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.498 2.132 . . . . 44.020000000000003 111.813 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 -58.96 136.89 58.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.505 -0.554 . . . . 72.219999999999999 109.505 175.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.403 ' HD3' ' OE2' ' A' ' 25' ' ' GLU . 74.3 mtt180 -113.35 139.45 48.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.853 0.358 . . . . 74.420000000000002 110.905 -175.095 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.4 t -105.38 118.49 52.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.02 -0.536 . . . . 62.119999999999997 110.68 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.933 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.9 mp -114.96 150.23 36.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.843 -0.617 . . . . 65.049999999999997 109.771 177.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.809 HG23 HD22 ' A' ' 77' ' ' LEU . 34.4 m -130.56 163.3 36.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.295 0.569 . . . . 72.019999999999996 111.233 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.44 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 41.2 t-80 -75.87 150.89 37.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.274 -0.875 . . . . 63.229999999999997 110.841 -176.307 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 24.4 mm-40 -38.74 -64.72 0.42 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.148 1.166 . . . . 73.030000000000001 114.148 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -67.38 -19.09 65.36 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.442 0.639 . . . . 65.030000000000001 110.963 -174.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.928 ' HB3' HG23 ' A' ' 47' ' ' ILE . 2.4 m-20 -85.73 -14.06 46.47 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.343 -0.844 . . . . 71.420000000000002 110.613 -176.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.809 HD22 HG23 ' A' ' 72' ' ' VAL . 1.6 mm? -52.72 -57.94 8.47 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.095 -0.502 . . . . 74.099999999999994 111.409 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.56 -42.88 83.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.996 -0.547 . . . . 55.140000000000001 111.056 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.42 -48.11 77.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.813 -0.708 . . . . 21.43 112.555 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.498 ' HB2' HG21 ' A' ' 47' ' ' ILE . . . -65.47 -47.31 76.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.648 0.261 . . . . 75.230000000000004 111.417 -178.012 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.539 ' HD2' HD12 ' A' ' 77' ' ' LEU . 39.3 mtp180 -64.44 -38.83 92.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.402 -0.363 . . . . 72.310000000000002 110.582 -177.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 82' ' ' ARG . 40.9 ttt-85 -66.42 -44.33 83.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.116 0.484 . . . . 64.200000000000003 110.389 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.4 tp -62.31 -47.52 83.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.586 -0.733 . . . . 73.519999999999996 111.283 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.87 -28.72 70.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 63.299999999999997 110.962 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.9 m -74.46 -39.15 62.7 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.827 0.346 . . . . 55.439999999999998 110.505 177.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -66.49 -37.02 84.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.024 0.44 . . . . 73.340000000000003 110.688 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.26 -17.27 52.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.971 -0.559 . . . . 74.310000000000002 111.172 178.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 78.16 28.54 55.92 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.863 -0.608 . . . . 73.200000000000003 112.796 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.8 mt -103.56 5.09 36.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.977 0.418 . . . . 74.019999999999996 110.639 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.819 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -76.22 73.03 3.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.297 0.57 . . . . 64.310000000000002 110.681 178.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -129.31 -34.24 1.86 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.759 -0.655 . . . . 63.140000000000001 110.407 179.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.602 ' HG3' HD22 ' A' ' 34' ' ' LEU . 51.7 mm-40 -98.18 8.7 44.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.582 -0.735 . . . . 75.019999999999996 111.011 -175.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.819 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.8 mp -80.99 121.34 25.92 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.822 -0.436 . . . . 65.400000000000006 109.822 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -79.43 80.19 5.82 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.51 0.671 . . . . 65.019999999999996 110.327 -177.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 39.6 t -111.98 83.66 1.83 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.263 -0.88 . . . . 71.349999999999994 108.994 175.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -64.89 -34.73 79.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.581 0.705 . . . . 75.329999999999998 109.116 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 p30 . . . . . 0 C--O 1.254 1.293 0 CA-C-N 114.858 -1.065 . . . . 71.409999999999997 109.254 176.378 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.4 ttp . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.802 0.335 . . . . 74.140000000000001 110.247 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.12 60.14 0.92 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.518 -0.849 . . . . 61.119999999999997 112.505 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 10.7 m -77.78 99.77 6.02 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.465 -0.568 . . . . 64.129999999999995 109.465 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.9 t -129.9 101.34 5.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.459 -0.337 . . . . 51.229999999999997 110.942 -174.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -82.76 132.3 35.18 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.624 -0.51 . . . . 64.420000000000002 109.624 176.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -98.9 122.82 42.65 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.253 0.549 . . . . 72.420000000000002 111.565 -173.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.0 p-80 -133.23 115.44 14.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.374 -0.83 . . . . 75.510000000000005 109.171 175.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 18.8 t-80 -138.28 -15.9 1.25 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.284 -0.416 . . . . 72.430000000000007 110.737 -176.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -76.61 77.07 3.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.184 0.516 . . . . 72.239999999999995 110.314 177.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -93.5 -33.6 13.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.62 -0.718 . . . . 74.439999999999998 109.646 178.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -82.65 114.1 20.79 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.516 -0.766 . . . . 64.019999999999996 110.066 177.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.0 t -140.22 107.65 5.56 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.991 -0.549 . . . . 70.099999999999994 110.482 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 107.2 146.99 13.41 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 111.325 -0.71 . . . . 53.140000000000001 111.325 -176.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.5 ptp85 -143.18 -14.65 0.69 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.141 0.47 . . . . 65.140000000000001 111.931 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -78.56 81.35 4.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.801 0.81 . . . . 75.400000000000006 110.803 -177.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -126.81 37.88 4.21 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.573 -1.269 . . . . 74.400000000000006 107.573 175.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.99 98.41 5.69 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.582 -1.19 . . . . 74.209999999999994 110.725 -174.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -123.88 -74.28 0.62 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.536 -0.913 . . . . 74.400000000000006 108.536 171.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.0 t80 70.26 -8.64 0.84 Allowed 'General case' 0 N--CA 1.471 0.586 0 O-C-N 123.96 0.787 . . . . 74.5 112.361 170.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -58.08 124.12 18.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.207 -0.451 . . . . 73.409999999999997 110.989 -177.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.601 ' HA3' ' HB2' ' A' ' 74' ' ' GLU . . . 146.8 111.71 0.69 Allowed Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 119.719 -1.229 . . . . 62.439999999999998 113.528 176.138 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.531 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -85.52 6.63 26.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.819 0.343 . . . . 61.409999999999997 110.434 172.407 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 22' ' ' HIS . 11.0 mp 84.31 139.17 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.22 1.008 . . . . 64.200000000000003 112.479 173.611 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -117.17 155.24 29.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.018 -0.992 . . . . 71.150000000000006 109.442 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.875 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 37.5 tt0 -85.09 121.87 28.49 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.844 -0.799 . . . . 75.219999999999999 108.844 171.039 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 93' ' ' LEU . 10.9 mp -87.42 -66.53 0.9 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.359 -0.382 . . . . 74.329999999999998 111.433 -176.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.542 HD21 HG11 ' A' ' 38' ' ' VAL . 4.0 pp -143.02 160.83 39.63 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.718 -0.393 . . . . 61.520000000000003 111.041 -175.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -144.07 129.18 18.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.513 -0.767 . . . . 74.299999999999997 109.385 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.401 HG21 HD23 ' A' ' 34' ' ' LEU . 11.2 t -151.49 163.46 38.96 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.964 0.411 . . . . 72.439999999999998 110.814 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -110.69 0.59 17.51 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.803 -0.635 . . . . 64.040000000000006 110.758 -177.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -94.43 123.55 37.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.892 0.377 . . . . 75.109999999999999 110.768 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.26 -27.77 63.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 61.200000000000003 111.75 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.28 -50.53 72.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.954 0.407 . . . . 71.319999999999993 110.284 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.401 HD23 HG21 ' A' ' 29' ' ' THR . 55.7 tp -62.4 -40.19 95.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.067 -0.515 . . . . 70.109999999999999 110.47 176.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.509 HD22 ' HD2' ' A' ' 68' ' ' ARG . 76.7 mt -62.15 -31.28 71.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.859 -0.61 . . . . 73.409999999999997 111.351 177.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.0 m -75.6 -44.84 40.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.792 0.33 . . . . 75.219999999999999 110.501 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.482 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -59.94 -50.5 73.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 64.340000000000003 111.055 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.542 HG11 HD21 ' A' ' 27' ' ' LEU . 95.8 t -69.84 -41.93 79.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-O 121.104 0.478 . . . . 65.019999999999996 110.448 178.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.62 -49.13 81.83 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.742 -0.663 . . . . 53.340000000000003 112.793 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.43 -26.41 67.85 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.704 0.261 . . . . 65.549999999999997 111.704 -177.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.561 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.6 mt -69.9 -52.25 26.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.018 0.437 . . . . 73.019999999999996 110.616 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.3 mt -74.5 -39.58 62.35 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.015 -0.538 . . . . 74.540000000000006 111.067 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -68.61 -42.4 78.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.998 -0.546 . . . . 74.129999999999995 110.794 -177.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.96 -29.31 67.18 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 121.12 -0.562 . . . . 51.530000000000001 112.737 -177.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -85.74 -0.75 56.08 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.68 -0.306 . . . . 74.510000000000005 111.184 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.7 t70 66.82 21.23 10.51 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.611 0.72 . . . . 74.349999999999994 110.941 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 63.6 mt -75.84 142.83 13.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.699 -0.682 . . . . 70.129999999999995 109.528 177.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.52 113.44 4.91 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.963 -0.637 . . . . 61.329999999999998 111.832 177.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 33.6 p-80 -128.3 99.3 5.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.328 0.585 . . . . 60.409999999999997 111.532 -173.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.6 tp -83.21 89.0 6.91 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.839 -0.619 . . . . 70.540000000000006 109.373 176.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.658 HG12 HG22 ' A' ' 70' ' ' VAL . 14.9 m -107.29 114.18 45.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.592 -0.731 . . . . 65.239999999999995 110.502 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 pp -130.82 135.25 47.56 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.054 -0.521 . . . . 73.230000000000004 110.79 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.504 ' HA ' ' HA ' ' A' ' 68' ' ' ARG . 2.5 p30 -107.59 175.43 5.49 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.539 -0.541 . . . . 64.409999999999997 109.539 175.36 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -113.39 86.35 2.37 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.16 0.505 . . . . 73.230000000000004 112.005 -172.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -110.44 96.51 6.24 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.488 -0.93 . . . . 54.25 108.488 169.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 27.9 ttt -122.62 77.23 1.41 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.88 -0.328 . . . . 73.010000000000005 111.304 -172.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.3 t 62.48 103.99 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.898 0.749 . . . . 64.519999999999996 112.035 174.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.3 tt -69.04 128.41 32.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.178 0.513 . . . . 30.25 110.36 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.606 HD23 ' HG2' ' A' ' 60' ' ' GLU . 5.8 tt -121.79 107.37 12.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.939 -0.763 . . . . 75.400000000000006 108.939 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.606 ' HG2' HD23 ' A' ' 59' ' ' LEU . 12.7 pt-20 43.73 -156.24 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 O-C-N 124.308 1.005 . . . . 61.210000000000001 112.262 -175.255 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -72.12 71.91 0.95 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.121 -0.561 . . . . 41.530000000000001 112.367 178.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.6 t -143.35 125.44 15.38 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.51 -0.552 . . . . 70.120000000000005 109.51 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.408 HD12 ' N ' ' A' ' 63' ' ' LEU . 5.9 mp -100.28 -34.57 9.94 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.285 0.564 . . . . 72.349999999999994 110.068 -178.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.64 -135.67 27.05 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 115.518 -0.765 . . . . 63.030000000000001 111.398 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.583 ' O ' ' HD3' ' A' ' 67' ' ' PRO . 58.7 t -134.47 126.36 48.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.103 -0.703 . . . . 71.209999999999994 109.103 176.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 66' ' ' ILE . 4.4 mp -110.68 85.69 5.06 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 110.019 -0.363 . . . . 73.140000000000001 110.019 178.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.583 ' HD3' ' O ' ' A' ' 65' ' ' VAL . 49.0 Cg_endo -97.57 105.99 0.08 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 123.256 2.637 . . . . 60.340000000000003 112.143 177.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.509 ' HD2' HD22 ' A' ' 35' ' ' LEU . 42.2 ttm180 -74.01 132.66 42.6 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.391 -0.596 . . . . 74.140000000000001 109.391 177.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -113.02 134.49 54.49 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.883 -0.599 . . . . 75.019999999999996 109.514 -174.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.658 HG22 HG12 ' A' ' 51' ' ' VAL . 42.5 t -112.85 118.63 58.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.097 -0.501 . . . . 71.420000000000002 110.8 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.875 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.1 mp -122.71 143.03 50.07 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.136 -0.484 . . . . 74.25 110.058 177.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.51 HG23 HD22 ' A' ' 77' ' ' LEU . 33.0 m -133.56 169.91 20.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.728 -0.215 . . . . 51.420000000000002 110.59 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -74.01 142.19 45.78 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.184 -0.673 . . . . 74.200000000000003 109.184 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.734 ' HA ' HD23 ' A' ' 77' ' ' LEU . 40.3 mt-10 -73.57 -8.46 56.06 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.198 0.814 . . . . 61.240000000000002 113.198 -171.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -86.31 -23.69 26.17 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.204 0.526 . . . . 73.420000000000002 109.77 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -101.18 8.65 42.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.745 -0.661 . . . . 61.039999999999999 110.132 172.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.734 HD23 ' HA ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -59.05 -55.39 35.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.823 -0.626 . . . . 72.439999999999998 110.115 -178.291 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.38 -36.32 71.11 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.129 -0.487 . . . . 64.409999999999997 111.12 177.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.37 -49.14 72.67 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.982 -0.628 . . . . 74.530000000000001 112.007 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.05 -42.94 93.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.502 0.192 . . . . 75.040000000000006 111.108 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.657 ' HD2' HD12 ' A' ' 77' ' ' LEU . 74.8 mtp180 -58.64 -47.25 85.05 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.507 -0.315 . . . . 74.140000000000001 110.412 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -58.72 -47.26 85.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 75.340000000000003 110.304 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.561 HD21 ' HB3' ' A' ' 41' ' ' LEU . 46.8 tp -60.94 -49.61 76.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.729 -0.669 . . . . 75.209999999999994 111.101 -178.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.526 HD21 HG13 ' A' ' 38' ' ' VAL . 84.5 mt -64.93 -36.77 85.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.471 -0.331 . . . . 75.109999999999999 111.351 -178.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 33.2 m -70.99 -41.76 70.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.899 0.38 . . . . 72.310000000000002 110.404 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -65.98 -34.51 78.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.939 -0.573 . . . . 64.540000000000006 110.694 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.54 -34.29 60.73 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.932 -0.576 . . . . 70.319999999999993 111.195 177.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 98.96 28.64 7.66 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.807 -0.711 . . . . 75.049999999999997 111.916 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 97.4 mt -113.79 -1.9 13.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.154 0.502 . . . . 72.420000000000002 110.897 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.569 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -75.0 93.61 2.74 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.547 . . . . 54.340000000000003 110.024 177.072 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -155.13 -44.71 0.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.96 -0.564 . . . . 75.120000000000005 110.346 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -84.27 10.6 10.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.097 -0.501 . . . . 65.5 111.209 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.569 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.3 mp -77.79 101.08 6.55 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.191 -0.459 . . . . 64.200000000000003 109.764 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.445 ' HA ' ' HD2' ' A' ' 94' ' ' ARG . 15.2 tpt180 -98.61 107.23 19.63 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.245 -0.434 . . . . 74.209999999999994 110.494 -175.042 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.7 p -121.37 170.2 9.86 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.869 -0.605 . . . . 75.349999999999994 110.615 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -89.74 103.05 15.73 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.292 -0.413 . . . . 73.140000000000001 110.112 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.33 -0.843 . . . . 73.400000000000006 109.692 177.377 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.9 tpt . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.637 0.256 . . . . 74.239999999999995 110.711 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.2 -6.56 0.15 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.018 -1.087 . . . . 74.450000000000003 113.177 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.1 p -76.39 100.42 5.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.194 0.521 . . . . 63.219999999999999 110.867 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.6 m -152.01 -171.17 3.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.921 -0.581 . . . . 74.540000000000006 109.682 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.6 t60 75.06 -36.0 0.3 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.077 0.551 . . . . 72.340000000000003 111.756 177.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -77.12 86.62 3.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.447 0.641 . . . . 75.540000000000006 109.887 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -135.96 121.95 20.07 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.495 -0.775 . . . . 73.230000000000004 109.202 -177.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -152.29 155.09 37.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.752 -0.203 . . . . 73.129999999999995 110.869 -177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -159.92 106.5 1.62 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.966 0.413 . . . . 73.409999999999997 110.292 176.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.7 t-80 -139.34 80.85 1.8 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.884 -0.598 . . . . 73.319999999999993 109.988 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.7 p -98.68 91.36 5.08 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.006 -0.543 . . . . 62.229999999999997 110.687 -178.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.1 p -132.58 110.89 10.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.046 -0.525 . . . . 63.240000000000002 111.095 -177.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 135.15 131.65 3.08 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.476 -0.869 . . . . 61.009999999999998 112.354 178.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -118.49 -37.38 3.32 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.8 0.333 . . . . 74.129999999999995 110.525 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -99.4 109.71 22.27 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.4 0.619 . . . . 64.230000000000004 110.682 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -160.46 31.6 0.16 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.902 -1.147 . . . . 72.140000000000001 107.902 175.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 76.9 mt -78.73 102.23 7.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.473 -1.239 . . . . 63.039999999999999 111.779 -171.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -122.05 139.36 53.8 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.659 -0.867 . . . . 73.129999999999995 108.659 172.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -67.76 -46.31 72.44 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 123.411 0.444 . . . . 72.109999999999999 111.64 -168.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.19 100.61 10.14 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.662 -0.496 . . . . 73.409999999999997 109.662 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -97.09 1.77 61.09 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.471 -0.871 . . . . 62.100000000000001 113.535 -173.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.424 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 53.5 t60 -97.62 10.62 39.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 117.088 0.444 . . . . 65.510000000000005 110.57 -177.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.612 HD22 ' HB2' ' A' ' 50' ' ' LEU . 8.6 mp 71.23 148.69 0.08 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.99 -0.55 . . . . 72.109999999999999 111.515 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 50.7 mtm180 -110.35 145.39 37.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.288 -0.415 . . . . 70.420000000000002 111.348 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.528 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 32.1 tt0 -70.88 110.96 5.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.651 -0.704 . . . . 70.040000000000006 109.877 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.477 HD22 HG21 ' A' ' 72' ' ' VAL . 57.0 tp -98.85 -38.23 9.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.211 -0.45 . . . . 50.240000000000002 111.348 -174.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.592 ' HG ' ' HB ' ' A' ' 70' ' ' VAL . 1.0 OUTLIER -142.55 148.8 38.16 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.259 0.552 . . . . 74.400000000000006 110.805 179.362 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 28' ' ' ARG . 22.5 ttt180 -138.63 104.61 5.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.334 -0.848 . . . . 71.319999999999993 109.113 -174.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.7 t -121.14 175.84 5.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.43 0.633 . . . . 63.32 112.052 -170.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -130.34 17.54 5.43 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.019 -0.991 . . . . 72.230000000000004 110.58 -175.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -128.34 126.58 41.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 72.310000000000002 111.25 -177.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.674 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -76.95 -26.39 53.95 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.067 -0.515 . . . . 71.299999999999997 111.678 -177.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.9 t -68.71 -45.9 80.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.077 0.465 . . . . 70.340000000000003 109.842 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.15 -38.86 90.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.857 -0.611 . . . . 73.219999999999999 110.303 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.674 HD12 ' HA ' ' A' ' 32' ' ' ALA . 69.1 mt -58.37 -37.7 75.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 74.209999999999994 111.281 176.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.3 m -64.99 -37.05 86.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 51.530000000000001 110.276 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.74 -54.15 8.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.999 -0.546 . . . . 65.409999999999997 111.08 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.574 HG11 HD11 ' A' ' 27' ' ' LEU . 99.5 t -60.58 -38.78 79.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.247 -0.433 . . . . 73.5 111.075 -178.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.66 -51.48 58.44 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.864 -0.607 . . . . 74.340000000000003 112.196 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.23 72.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.644 0.259 . . . . 32.439999999999998 111.355 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 84.1 mt -65.69 -52.14 53.83 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.937 0.399 . . . . 62.020000000000003 110.725 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.4 mt -70.53 -39.1 74.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.919 -0.582 . . . . 74.299999999999997 110.563 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.73 -36.74 81.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 71.010000000000005 110.403 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.85 -24.25 62.51 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 121.047 -0.596 . . . . 64.109999999999999 113.067 -179.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.61 6.82 42.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.927 0.364 . . . . 74.120000000000005 111.464 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.1 t70 67.42 21.2 9.75 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.479 0.657 . . . . 64.420000000000002 110.372 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.818 HG23 ' HB3' ' A' ' 76' ' ' ASP . 78.5 mt -83.14 128.48 38.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.053 -0.521 . . . . 75.129999999999995 110.268 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.32 113.48 5.87 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.104 -0.57 . . . . 71.400000000000006 112.056 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.56 137.54 52.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.117 0.484 . . . . 74.430000000000007 111.431 -177.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.853 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 5.9 tt -107.79 95.17 5.5 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.901 -0.778 . . . . 54.539999999999999 108.901 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.454 HG11 HG22 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -142.98 110.9 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.582 -0.736 . . . . 64.25 110.176 178.144 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -113.67 135.51 53.85 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.108 -0.496 . . . . 74.329999999999998 110.886 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -81.23 68.62 7.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.751 0.786 . . . . 45.299999999999997 109.791 175.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -136.7 117.14 13.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.96 -1.018 . . . . 72.129999999999995 109.433 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -152.96 -50.83 0.1 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.903 -0.59 . . . . 72.400000000000006 110.091 -177.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -151.78 171.54 17.54 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.1 -0.704 . . . . 42.409999999999997 109.1 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.6 m -70.53 146.8 49.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 110.174 -0.306 . . . . 71.420000000000002 110.174 177.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 8.1 tt -73.35 116.36 15.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.393 0.615 . . . . 75.25 111.135 -178.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.0 tp -158.34 111.17 2.35 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.44 -0.8 . . . . 70.25 109.901 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 67.89 170.46 0.27 Allowed 'General case' 0 C--O 1.234 0.24 0 O-C-N 123.815 0.697 . . . . 72.319999999999993 111.111 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -80.05 91.22 1.31 Allowed Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 110.901 -0.879 . . . . 64.420000000000002 110.901 172.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.679 ' HB3' HG12 ' A' ' 65' ' ' VAL . 15.6 m -54.73 127.72 29.54 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 122.715 0.406 . . . . 54.119999999999997 111.281 -175.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 63' ' ' LEU . 6.3 mp -80.15 80.63 6.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.904 -0.589 . . . . 71.340000000000003 111.496 -174.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 53.58 41.25 64.33 Favored Glycine 0 C--N 1.332 0.313 0 CA-C-N 115.861 -0.609 . . . . 52.009999999999998 113.717 175.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.679 HG12 ' HB3' ' A' ' 62' ' ' SER . 9.7 p -105.96 15.24 7.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.467 0.651 . . . . 41.43 110.615 -177.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.3 mp -120.22 88.07 40.95 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.279 -0.419 . . . . 74.019999999999996 110.634 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -81.65 141.41 12.29 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.357 2.038 . . . . 65.400000000000006 110.251 171.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.471 ' HA ' ' NE ' ' A' ' 68' ' ' ARG . 5.3 mmp_? -127.57 150.83 49.54 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.46 0.648 . . . . 75.530000000000001 111.417 -175.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.492 ' HD3' ' OE1' ' A' ' 25' ' ' GLU . 18.9 ptp180 -114.72 136.85 52.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.832 -1.076 . . . . 74.329999999999998 108.948 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.592 ' HB ' ' HG ' ' A' ' 27' ' ' LEU . 97.8 t -108.52 114.4 46.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 120.953 0.406 . . . . 71.109999999999999 110.272 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.853 ' HB2' ' HB3' ' A' ' 50' ' ' LEU . 8.5 mp -101.53 140.12 36.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.573 -0.74 . . . . 71.430000000000007 109.4 176.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.864 HG23 HD22 ' A' ' 77' ' ' LEU . 23.9 m -126.16 162.94 28.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.325 0.583 . . . . 71.319999999999993 111.13 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.463 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 2.5 t-160 -74.22 162.19 29.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.079 -0.964 . . . . 70.340000000000003 110.257 -175.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.588 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 26.0 mm-40 -58.09 -58.88 6.49 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.85 0.685 . . . . 71.329999999999998 112.85 -174.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -73.33 -25.31 60.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.557 0.694 . . . . 64.239999999999995 110.041 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.818 ' HB3' HG23 ' A' ' 47' ' ' ILE . 1.5 m-20 -74.24 -14.65 60.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.168 -0.923 . . . . 63.539999999999999 110.63 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.864 HD22 HG23 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -53.49 -57.79 9.44 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.01 0.524 . . . . 71.040000000000006 111.249 -177.338 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.8 -38.34 90.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.691 -0.686 . . . . 70.129999999999995 111.04 -178.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.52 -44.99 94.37 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.902 -0.666 . . . . 74.420000000000002 112.124 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.58 97.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.728 0.299 . . . . 74.319999999999993 110.714 179.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -60.88 -50.94 71.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.43 . . . . 63.32 110.59 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -57.67 -43.95 85.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 64.510000000000005 110.819 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.6 tp -59.84 -54.74 42.67 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.028 -0.533 . . . . 72.030000000000001 111.054 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.479 HD21 HG13 ' A' ' 38' ' ' VAL . 90.4 mt -63.18 -30.78 71.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.996 -0.547 . . . . 75.310000000000002 111.385 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 88.4 m -66.79 -43.0 85.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.573 0.225 . . . . 72.349999999999994 110.812 178.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -69.09 -34.11 74.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.978 0.418 . . . . 60.509999999999998 110.582 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.95 -4.26 54.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.904 -0.589 . . . . 73.109999999999999 111.673 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 72.32 21.67 79.24 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.99 -0.624 . . . . 72.030000000000001 112.785 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.0 mt -105.47 10.26 33.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.08 0.467 . . . . 73.209999999999994 110.829 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.724 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -73.78 77.09 1.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.45 -0.574 . . . . 61.530000000000001 109.45 174.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -131.56 -51.22 0.99 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.332 -0.849 . . . . 71.329999999999998 110.421 -172.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -91.74 8.83 35.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.598 -0.728 . . . . 75.420000000000002 110.974 -176.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.724 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.3 mp -73.47 134.37 43.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.168 -0.469 . . . . 73.5 110.319 -178.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 53.3 mtt180 -149.8 165.35 32.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.064 -0.516 . . . . 72.109999999999999 110.8 -177.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 68.9 m -152.96 139.7 18.93 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.609 -0.723 . . . . 71.420000000000002 109.123 173.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -80.66 83.33 6.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.522 -0.547 . . . . 74.129999999999995 109.522 178.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 27.2 t70 . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.466 -0.778 . . . . 73.319999999999993 110.507 -174.838 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 110.045 -0.354 . . . . 61.149999999999999 110.045 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 102.24 126.66 5.9 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.599 -0.81 . . . . 61.43 112.951 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.4 t -130.94 125.47 33.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.648 -0.871 . . . . 70.219999999999999 108.648 173.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.3 m -139.78 117.96 11.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.112 0.482 . . . . 30.23 111.658 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -162.7 96.01 0.92 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.614 -0.721 . . . . 75.430000000000007 109.748 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -140.3 92.16 2.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.831 0.824 . . . . 52.030000000000001 111.194 178.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -131.68 85.75 2.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.743 -0.662 . . . . 74.430000000000007 109.825 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.3 t-80 -160.2 84.04 0.72 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.787 -0.642 . . . . 71.540000000000006 110.457 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -157.46 42.65 0.32 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.45 -0.574 . . . . 74.010000000000005 109.45 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 35.9 t-80 -83.98 86.92 7.12 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.975 -0.75 . . . . 74.010000000000005 108.975 176.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.6 m -155.07 102.66 2.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.695 -0.684 . . . . 63.109999999999999 109.92 -175.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -149.65 114.42 5.33 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.374 -0.376 . . . . 60.450000000000003 110.399 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -107.86 169.66 14.69 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.733 -0.746 . . . . 62.219999999999999 111.795 178.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -115.71 102.78 10.05 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.063 0.459 . . . . 71.439999999999998 110.792 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -82.97 132.66 35.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.035 0.445 . . . . 73.019999999999996 110.071 177.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -93.91 123.36 37.22 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.938 -0.574 . . . . 61.409999999999997 110.914 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.8 mt -135.11 106.26 6.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.166 -0.47 . . . . 70.140000000000001 110.777 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -92.98 -66.42 0.93 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.027 0.441 . . . . 71.209999999999994 109.973 174.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.0 t80 62.56 -170.53 0.17 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.062 -0.972 . . . . 74.230000000000004 109.836 -176.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -142.52 136.37 29.27 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.172 -0.677 . . . . 74.230000000000004 109.172 178.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.402 ' HA3' ' HG2' ' A' ' 24' ' ' ARG . . . -135.11 -68.24 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 119.702 -1.237 . . . . 63.520000000000003 113.28 -176.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 32.9 m80 57.27 83.45 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.35 -0.611 . . . . 74.519999999999996 109.35 -169.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.3 mt 66.55 101.17 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.343 -0.844 . . . . 74.049999999999997 110.027 -168.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.498 ' HB2' HD23 ' A' ' 77' ' ' LEU . 87.7 mtt180 -107.11 147.78 29.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.082 -0.508 . . . . 73.409999999999997 110.189 -174.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.621 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 35.7 tt0 -72.83 136.67 45.41 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.529 -0.545 . . . . 63.420000000000002 109.529 177.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.639 HD12 HD22 ' A' ' 27' ' ' LEU . 1.4 tm? -97.75 -50.45 4.45 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.716 -0.476 . . . . 61.549999999999997 109.716 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.639 HD22 HD12 ' A' ' 26' ' ' LEU . 2.6 pt? -158.39 157.98 33.35 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.472 -0.331 . . . . 75.099999999999994 110.805 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.19 132.03 42.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.834 -0.621 . . . . 63.32 110.16 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.4 t -142.99 170.96 14.72 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.917 -0.401 . . . . 74.299999999999997 109.917 176.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.638 ' HA ' ' HA ' ' A' ' 67' ' ' PRO . 4.2 p-10 -116.67 9.63 14.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.347 0.594 . . . . 64.329999999999998 110.008 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -117.09 128.37 55.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.539 -0.755 . . . . 71.349999999999994 111.266 -175.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.703 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -77.54 -21.07 53.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.819 -0.628 . . . . 54.409999999999997 111.705 -176.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.7 t -69.18 -49.39 62.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.156 0.503 . . . . 65.040000000000006 109.849 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.5 tp -60.91 -37.51 82.52 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.641 -0.709 . . . . 63.340000000000003 110.231 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.703 HD12 ' HA ' ' A' ' 32' ' ' ALA . 78.5 mt -59.34 -35.15 73.32 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.98 -0.555 . . . . 61.299999999999997 111.072 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -69.74 -42.54 73.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.4 -0.364 . . . . 71.209999999999994 110.445 179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.498 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.77 -53.17 44.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 63.439999999999998 111.04 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.525 HG13 HD21 ' A' ' 84' ' ' LEU . 99.1 t -61.43 -40.57 86.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 121.127 0.489 . . . . 74.230000000000004 110.591 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.4 -48.48 85.97 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.685 -0.689 . . . . 73.209999999999994 111.979 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.63 -28.48 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 62.439999999999998 111.443 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 88.3 mt -67.13 -51.64 51.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.863 0.364 . . . . 72.049999999999997 110.559 177.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 82.5 mt -72.43 -39.11 68.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.98 -0.555 . . . . 75.120000000000005 110.665 -177.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -66.92 -41.2 87.45 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.463 -0.79 . . . . 73.230000000000004 110.666 -178.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -80.08 -11.79 84.03 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.622 -0.799 . . . . 62.549999999999997 112.83 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -102.85 4.22 37.5 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.711 -0.288 . . . . 61.240000000000002 111.225 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.4 t70 63.15 32.48 15.11 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.682 0.753 . . . . 71.530000000000001 110.575 178.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 68.6 mt -93.58 130.09 43.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.884 -0.598 . . . . 63.119999999999997 110.308 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.18 117.96 6.59 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.929 -0.578 . . . . 62.32 112.165 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 54.0 p-80 -139.53 142.53 37.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.078 0.466 . . . . 44.340000000000003 110.935 -175.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 tp -113.31 115.82 28.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.971 -0.558 . . . . 73.230000000000004 110.824 -176.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.7 m -132.25 136.31 56.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.582 -0.736 . . . . 73.420000000000002 109.753 173.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.401 ' N ' HD12 ' A' ' 52' ' ' LEU . 5.9 mp -104.82 -86.67 0.46 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.288 -0.264 . . . . 74.099999999999994 110.288 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 t70 69.34 -174.4 0.19 Allowed 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.871 0.732 . . . . 72.120000000000005 111.934 173.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 54.3 tp60 -111.3 -30.46 7.42 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.854 -0.612 . . . . 75.010000000000005 110.279 -175.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.406 ' O ' ' HB2' ' A' ' 56' ' ' MET . 4.4 t30 73.32 -44.89 0.6 Allowed 'General case' 0 N--CA 1.473 0.718 0 O-C-N 124.004 0.815 . . . . 65.420000000000002 110.919 -175.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.406 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 24.6 mmt 73.72 160.15 0.23 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.815 0.846 . . . . 62.229999999999997 111.244 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.9 m -83.95 89.47 7.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.427 0.632 . . . . 75.299999999999997 109.336 174.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.5 tt -75.6 135.21 27.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.298 -0.864 . . . . 70.329999999999998 112.199 -171.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 46.1 tp -125.22 -53.54 1.61 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.954 -1.128 . . . . 75.510000000000005 107.954 171.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -121.48 130.41 53.54 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.441 -0.948 . . . . 52.409999999999997 108.441 169.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -112.56 131.66 10.27 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.555 -0.831 . . . . 65.230000000000004 112.809 -175.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 27.2 t -166.74 146.43 5.65 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 110.231 -0.285 . . . . 72.530000000000001 110.231 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.4 mt 65.34 -173.72 0.18 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.789 0.681 . . . . 73.319999999999993 111.791 176.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -128.08 118.53 2.87 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.507 -1.037 . . . . 22.109999999999999 110.507 172.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.522 HG23 HG13 ' A' ' 66' ' ' ILE . 25.3 m -104.57 -7.18 9.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 117.012 0.406 . . . . 74.239999999999995 111.553 -175.184 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.522 HG13 HG23 ' A' ' 65' ' ' VAL . 74.3 mt -122.41 124.41 26.81 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 116.17 -0.468 . . . . 43.350000000000001 110.451 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.638 ' HA ' ' HA ' ' A' ' 30' ' ' ASN . 10.4 Cg_exo -71.7 86.21 0.89 Allowed 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.72 2.28 . . . . 74.5 111.231 174.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.636 ' HB3' HD11 ' A' ' 35' ' ' LEU . 12.7 tpp180 -93.99 135.47 35.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.513 0.673 . . . . 75.310000000000002 110.952 -175.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.478 ' HD2' ' OE1' ' A' ' 25' ' ' GLU . 18.1 ptt180 -119.01 145.97 45.42 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.414 -0.812 . . . . 62.210000000000001 110.122 178.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.2 t -105.18 123.3 59.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.859 -0.609 . . . . 61.229999999999997 110.101 -177.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.621 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 9.6 mp -103.88 155.34 18.7 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.402 -0.592 . . . . 75.140000000000001 109.402 175.4 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.4 m -137.82 168.49 20.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.773 0.32 . . . . 62.130000000000003 110.399 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.424 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 27.6 m80 -73.42 160.51 31.65 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.95 -0.759 . . . . 73.519999999999996 108.95 176.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.32 -11.07 60.54 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.983 0.421 . . . . 72.409999999999997 110.849 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -91.71 -23.18 19.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.031 -0.532 . . . . 75.310000000000002 110.729 174.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.424 ' OD1' ' HB2' ' A' ' 73' ' ' HIS . 9.8 m-20 -93.76 -13.31 27.54 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.873 -0.603 . . . . 73.319999999999993 110.213 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.498 HD23 ' HB2' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -52.74 -57.08 11.29 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.639 -0.71 . . . . 74.420000000000002 111.183 -176.462 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.85 97.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.383 -0.371 . . . . 71.109999999999999 111.322 -177.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.8 -46.67 81.41 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.816 -0.706 . . . . 71.120000000000005 112.446 -177.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.51 -41.21 96.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.653 0.263 . . . . 73.310000000000002 111.413 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -60.47 -53.02 62.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.338 -0.392 . . . . 73.439999999999998 111.241 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -64.34 -32.62 74.3 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.704 0.261 . . . . 63.100000000000001 111.704 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.59 -54.65 32.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.783 0.325 . . . . 71.200000000000003 110.707 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.525 HD21 HG13 ' A' ' 38' ' ' VAL . 11.3 mp -65.46 -31.71 72.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 73.540000000000006 111.442 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.727 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 85.7 m -64.31 -46.28 84.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.739 0.304 . . . . 44.399999999999999 110.782 178.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.73 -29.79 69.11 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.036 0.446 . . . . 71.019999999999996 110.457 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.3 -14.79 60.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.183 -0.462 . . . . 74.230000000000004 111.131 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.64 9.57 66.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.798 -0.715 . . . . 73.099999999999994 112.415 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 79.9 mt -96.88 14.29 25.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.917 0.389 . . . . 71.549999999999997 110.727 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.788 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -71.57 80.6 0.81 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.035 -0.529 . . . . 52.119999999999997 110.668 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -134.96 -58.12 0.81 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.939 -0.573 . . . . 64.329999999999998 109.883 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' A' ' 94' ' ' ARG . 77.0 mm-40 -90.67 7.84 37.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.221 -0.445 . . . . 74.299999999999997 111.751 -178.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.788 HD13 ' HA ' ' A' ' 90' ' ' ALA . 10.8 mp -61.29 118.94 7.55 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.811 -0.44 . . . . 71.129999999999995 109.811 176.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.535 ' HG3' ' O ' ' A' ' 92' ' ' GLU . 58.0 mtt180 -121.34 135.58 55.07 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.566 0.698 . . . . 75.329999999999998 112.417 -172.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.7 m -156.48 81.12 0.97 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.595 -1.261 . . . . 70.409999999999997 107.595 173.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -85.65 126.39 33.89 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.797 -0.638 . . . . 63.350000000000001 111.63 -168.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.354 -0.831 . . . . 74.329999999999998 109.048 175.558 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.479 1.024 0 CA-C-O 120.883 0.373 . . . . 64.310000000000002 110.416 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.02 130.16 5.36 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.868 -0.682 . . . . 63.310000000000002 111.879 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.0 p -121.69 -171.81 2.3 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.937 -0.394 . . . . 73.319999999999993 109.937 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.7 t -143.02 130.81 21.48 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.877 -0.416 . . . . 60.439999999999998 109.877 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -75.86 140.29 42.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.274 -0.421 . . . . 74.120000000000005 110.058 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -88.34 124.01 33.49 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.922 0.392 . . . . 73.329999999999998 111.275 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -146.55 166.3 26.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 74.129999999999995 110.355 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.1 p-80 -170.45 152.59 4.02 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.372 -0.603 . . . . 71.340000000000003 109.372 175.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -151.09 126.7 10.17 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.205 0.526 . . . . 73.019999999999996 111.801 -178.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -135.02 136.39 42.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.677 -0.692 . . . . 73.439999999999998 109.538 172.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.8 m -126.9 107.21 9.89 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.848 0.356 . . . . 73.230000000000004 110.579 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.0 m -110.66 112.3 24.09 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.153 -0.476 . . . . 73.299999999999997 110.531 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 155.63 142.43 3.43 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.506 -0.854 . . . . 74.510000000000005 112.816 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 14' ' ' ARG . 37.3 ttm180 -129.53 134.33 47.71 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.661 -0.496 . . . . 75.120000000000005 109.661 175.354 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -140.33 94.72 2.77 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.048 0.451 . . . . 75.430000000000007 110.922 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -135.97 17.16 3.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 72.219999999999999 110.615 177.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 39.6 tp -76.37 136.46 39.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.272 -0.422 . . . . 71.150000000000006 110.118 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 74.2 -13.71 0.76 Allowed 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.896 0.747 . . . . 75.120000000000005 111.535 -178.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -70.86 -36.55 72.87 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.442 -0.577 . . . . 73.209999999999994 109.442 174.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -67.47 118.86 11.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.05 -0.977 . . . . 60.109999999999999 110.717 176.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 177.68 -18.73 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.691 -0.766 . . . . 70.5 113.214 177.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -122.19 -136.28 0.31 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.254 0.527 . . . . 73.519999999999996 110.249 -175.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.623 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . 6.0 mp -125.09 144.75 50.26 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.709 -0.478 . . . . 75.019999999999996 109.709 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.415 ' HG2' ' HG2' ' A' ' 74' ' ' GLU . 22.9 mmt180 -123.98 155.03 38.96 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.889 -0.411 . . . . 71.030000000000001 109.889 -178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -62.67 111.29 2.02 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 121.201 0.524 . . . . 73.099999999999994 110.813 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.6 tp -80.99 -23.03 39.01 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.166 -0.925 . . . . 72.109999999999999 108.809 175.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.506 ' HA ' ' HA ' ' A' ' 94' ' ' ARG . 0.7 OUTLIER 179.18 162.17 0.8 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.011 -0.995 . . . . 64.010000000000005 109.524 176.898 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -149.19 147.53 28.54 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.467 -0.568 . . . . 72.129999999999995 109.467 -179.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.411 HG22 HD21 ' A' ' 35' ' ' LEU . 13.4 t -170.1 169.36 7.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.979 0.419 . . . . 61.399999999999999 110.56 178.482 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -97.08 -8.8 29.38 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.909 -0.587 . . . . 74.450000000000003 110.678 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -82.28 148.54 28.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.375 -0.375 . . . . 74.329999999999998 110.625 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.63 -9.8 14.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.52 -0.309 . . . . 60.329999999999998 111.514 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.1 t -79.05 -43.53 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.289 0.566 . . . . 74.420000000000002 111.012 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.606 HD21 HD13 ' A' ' 89' ' ' LEU . 39.5 tp -70.1 -41.05 74.52 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.805 -0.634 . . . . 50.140000000000001 110.741 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.453 ' CD1' ' HB3' ' A' ' 68' ' ' ARG . 68.2 mt -64.87 -36.2 83.57 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.126 0.417 . . . . 73.329999999999998 112.126 -174.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.0 p -66.76 -29.7 69.73 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.99 0.424 . . . . 63.439999999999998 110.575 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.4 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.38 -42.95 61.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.452 . . . . 74.349999999999994 110.108 176.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 34' ' ' LEU . 61.6 t -57.3 -41.97 79.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.716 -0.675 . . . . 74.329999999999998 110.408 176.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -56.61 -50.59 62.12 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.41 -0.814 . . . . 74.430000000000007 112.305 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.94 -34.29 71.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.74 0.305 . . . . 73.0 111.406 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 83.5 mt -67.19 -46.46 73.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.111 0.482 . . . . 72.439999999999998 110.174 178.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.9 mt -69.12 -31.69 70.55 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.879 -0.601 . . . . 72.209999999999994 111.162 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -71.07 -38.72 72.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.266 -0.425 . . . . 61.009999999999998 110.081 175.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.01 -43.01 94.37 Favored Glycine 0 C--N 1.332 0.338 0 CA-C-N 115.956 -0.566 . . . . 50.329999999999998 112.452 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.4 -10.18 59.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.874 0.369 . . . . 72.409999999999997 110.66 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t70 61.92 34.65 16.75 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.386 -0.824 . . . . 73.340000000000003 110.906 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.2 mt -85.13 -29.35 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.724 0.773 . . . . 55.43 109.568 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.6 169.65 37.17 Favored Glycine 0 N--CA 1.447 -0.613 0 CA-C-N 114.987 -1.006 . . . . 44.100000000000001 111.595 -177.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -160.93 137.78 8.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.961 0.41 . . . . 52.25 111.954 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 2.8 tm? -109.75 103.25 12.05 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 107.755 -1.202 . . . . 51.520000000000003 107.755 168.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.597 HG12 HG22 ' A' ' 70' ' ' VAL . 3.1 m -119.53 87.84 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.516 0.674 . . . . 63.25 111.493 -174.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 97.4 mt -128.82 162.14 28.17 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.367 -0.833 . . . . 62.450000000000003 110.336 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.494 ' HA ' ' HA ' ' A' ' 68' ' ' ARG . 4.4 p-10 -95.27 -97.95 0.17 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.398 -0.365 . . . . 73.140000000000001 111.616 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.449 ' H ' ' CG ' ' A' ' 53' ' ' ASP . 18.7 mm-40 -113.62 -84.03 0.6 Allowed 'General case' 0 C--N 1.327 -0.376 0 O-C-N 122.199 -0.313 . . . . 75.150000000000006 111.654 -175.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -167.12 157.56 11.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.432 -0.349 . . . . 73.409999999999997 110.563 -173.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.5 tpt -105.87 116.0 31.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.196 -0.456 . . . . 61.509999999999998 110.365 178.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 57.9 m -153.67 122.89 6.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.172 -0.467 . . . . 73.129999999999995 110.066 177.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 6.9 tp -72.58 109.68 4.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.727 0.775 . . . . 63.329999999999998 111.114 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 55.6 tp -140.63 155.14 46.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.581 -0.736 . . . . 73.25 109.109 178.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -73.7 107.0 5.7 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.641 0.734 . . . . 65.109999999999999 110.702 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 169.27 147.83 5.58 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.418 -1.073 . . . . 30.030000000000001 110.418 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 m -87.33 -26.93 23.14 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.964 0.382 . . . . 72.340000000000003 111.186 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.447 ' HB3' ' H ' ' A' ' 64' ' ' GLY . 10.1 mp 61.74 -157.06 0.34 Allowed 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.188 -0.46 . . . . 75.530000000000001 110.37 -178.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.447 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . 156.99 -30.76 0.54 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.474 -0.869 . . . . 73.510000000000005 112.562 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 47.5 t -81.88 106.7 13.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.918 0.389 . . . . 61.240000000000002 110.371 -179.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 49.9 mm -119.22 91.86 44.54 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 116.143 -0.48 . . . . 72.530000000000001 110.257 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -95.1 99.82 0.11 Allowed 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 123.238 2.625 . . . . 71.099999999999994 111.536 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.494 ' HA ' ' HA ' ' A' ' 53' ' ' ASP . 55.8 ttm-85 -89.32 136.31 33.09 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.908 -0.404 . . . . 73.239999999999995 109.908 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.99 141.94 46.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.239 -0.437 . . . . 51.439999999999998 110.362 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.597 HG22 HG12 ' A' ' 51' ' ' VAL . 48.1 t -102.38 106.94 20.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.663 -0.699 . . . . 74.510000000000005 109.838 177.566 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.623 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 10.3 mp -106.12 132.86 51.69 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.901 0.382 . . . . 62.350000000000001 111.103 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.3 m -120.77 155.25 24.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.307 -0.627 . . . . 65.030000000000001 109.307 173.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.434 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 7.5 t-80 -64.37 144.79 56.91 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.893 -0.41 . . . . 61.100000000000001 109.893 -178.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.528 ' HA ' HD23 ' A' ' 77' ' ' LEU . 42.6 mt-10 -71.6 69.23 0.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.299 0.571 . . . . 72.25 111.864 -176.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -141.98 -51.53 0.41 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.2 -0.909 . . . . 70.019999999999996 109.477 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -108.88 43.73 1.22 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.425 -0.807 . . . . 74.25 111.733 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 74' ' ' GLU . 4.1 mm? -65.18 -52.89 52.13 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.712 -0.477 . . . . 61.009999999999998 109.712 175.439 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.9 -22.64 62.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.203 -0.453 . . . . 73.239999999999995 110.942 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.24 -48.05 15.92 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 121.04 -0.6 . . . . 75.120000000000005 112.017 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.04 -38.62 86.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.776 0.322 . . . . 60.109999999999999 110.467 177.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.45 HH11 ' HD2' ' A' ' 81' ' ' ARG . 21.0 mtp180 -62.1 -28.23 69.47 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.119 -0.491 . . . . 71.450000000000003 110.406 175.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -69.8 -51.1 36.69 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.497 -0.557 . . . . 73.409999999999997 109.497 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.3 tp -60.01 -51.65 68.75 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.113 -0.949 . . . . 62.509999999999998 111.631 -177.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.0 mp -63.05 -27.58 69.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 73.329999999999998 111.844 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.889 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 70.1 m -81.45 -43.24 19.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.824 0.345 . . . . 73.340000000000003 111.08 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.69 -44.14 78.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 71.310000000000002 110.881 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.09 87.86 1.22 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.227 -0.442 . . . . 73.150000000000006 110.717 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -172.47 -69.43 0.04 OUTLIER Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.447 -0.883 . . . . 33.530000000000001 111.987 176.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.692 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -164.12 -56.65 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.637 0.256 . . . . 74.400000000000006 110.937 -175.966 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.889 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 60.6 13.37 4.19 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.72 -0.673 . . . . 71.340000000000003 112.168 -177.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -87.23 -40.99 14.04 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.131 -0.227 . . . . 72.140000000000001 110.992 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -93.5 -81.61 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.997 -0.281 . . . . 72.349999999999994 111.228 -177.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 96.1 mt 53.48 43.59 31.08 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.743 0.782 . . . . 71.310000000000002 109.521 -172.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.506 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 49.6 ttt180 64.31 89.15 0.09 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 113.693 -1.594 . . . . 62.0 111.048 -173.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 19.4 m -74.76 89.15 2.28 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.732 -0.84 . . . . 62.240000000000002 108.732 170.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -82.65 88.16 6.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.574 -0.739 . . . . 73.409999999999997 110.147 -173.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.7 t70 . . . . . 0 C--O 1.247 0.932 0 CA-C-N 115.35 -0.841 . . . . 75.420000000000002 110.318 -174.797 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.736 0.303 . . . . 73.150000000000006 110.326 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.12 100.41 0.29 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.784 -0.722 . . . . 70.209999999999994 112.542 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.7 t -84.8 127.68 34.25 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.312 -0.625 . . . . 73.420000000000002 109.312 177.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.6 p -120.33 101.09 7.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.203 0.525 . . . . 54.439999999999998 111.061 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -158.81 118.91 3.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.702 -0.681 . . . . 44.119999999999997 110.617 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -149.98 115.86 5.62 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.537 -0.912 . . . . 62.439999999999998 108.537 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -93.41 106.21 18.2 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.389 -0.369 . . . . 70.239999999999995 110.689 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 24.1 p-80 -104.57 113.63 27.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.421 0.629 . . . . 70.409999999999997 110.936 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -149.37 108.03 3.83 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.592 -0.731 . . . . 73.519999999999996 109.918 174.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -160.72 125.9 3.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.135 -0.484 . . . . 63.140000000000001 110.515 -177.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.4 p -155.27 86.41 1.09 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.026 -0.533 . . . . 72.239999999999995 110.281 177.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.5 m -152.46 124.81 8.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.169 -0.469 . . . . 74.519999999999996 110.79 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 140.56 97.33 0.32 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.966 -0.635 . . . . 61.140000000000001 112.285 176.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.7 ttp180 -106.73 -41.1 5.32 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.496 -0.557 . . . . 71.040000000000006 109.496 177.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 65.72 92.24 0.08 Allowed 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.364 -0.835 . . . . 62.520000000000003 111.908 175.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -143.58 -47.1 0.29 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.931 -0.577 . . . . 75.329999999999998 110.894 178.154 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -90.8 122.56 33.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.142 -0.481 . . . . 71.209999999999994 110.188 -174.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -80.15 97.4 6.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.838 -0.619 . . . . 74.340000000000003 110.564 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -84.81 170.31 13.3 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.079 -0.51 . . . . 62.509999999999998 110.714 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.432 ' HG2' ' H ' ' A' ' 22' ' ' HIS . 32.8 tt0 -99.97 119.6 38.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.091 0.472 . . . . 61.5 111.092 -175.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.67 26.92 8.52 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.755 -0.736 . . . . 61.450000000000003 112.25 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.444 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 17.9 t-80 -94.01 -10.65 32.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.744 0.307 . . . . 52.32 110.228 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 22' ' ' HIS . 8.7 mp 71.93 151.14 0.1 Allowed 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.525 -0.761 . . . . 75.219999999999999 111.783 178.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -125.36 166.04 17.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.459 -0.791 . . . . 71.519999999999996 109.162 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.803 ' HG2' ' HD2' ' A' ' 69' ' ' ARG . 2.0 mp0 -77.92 124.25 27.77 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.284 -0.635 . . . . 64.340000000000003 109.284 171.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.521 ' HB3' HD23 ' A' ' 27' ' ' LEU . 1.1 tm? -77.17 -30.73 55.03 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 108.801 -0.814 . . . . 74.5 108.801 177.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.521 HD23 ' HB3' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -170.08 160.53 8.17 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.563 -0.744 . . . . 73.230000000000004 110.84 -175.197 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.513 ' HD3' ' HB3' ' A' ' 67' ' ' PRO . 6.0 tmm_? -127.56 106.48 9.2 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 107.0 -1.481 . . . . 74.439999999999998 107.0 170.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.5 HG21 HD21 ' A' ' 35' ' ' LEU . 14.6 t -78.25 164.2 25.1 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.482 0.658 . . . . 72.230000000000004 111.573 -166.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -114.7 -3.5 12.84 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.159 -0.928 . . . . 55.5 110.397 178.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -131.93 147.2 52.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.504 -0.316 . . . . 44.450000000000003 110.995 -175.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -93.74 -23.35 18.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.346 -0.388 . . . . 63.229999999999997 111.532 -175.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.0 t -79.18 -37.78 19.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.319 0.58 . . . . 71.099999999999994 110.0 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.3 tp -57.03 -32.25 65.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.413 -0.812 . . . . 72.099999999999994 111.284 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.5 HD21 HG21 ' A' ' 29' ' ' THR . 93.5 mt -56.08 -39.6 72.34 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.944 0.402 . . . . 74.409999999999997 111.446 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.4 m -64.95 -26.85 68.48 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.886 -0.597 . . . . 51.409999999999997 110.895 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.21 -47.9 10.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.267 -0.424 . . . . 55.229999999999997 110.639 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.429 ' HA ' HD12 ' A' ' 41' ' ' LEU . 86.4 t -58.58 -40.54 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.163 -0.472 . . . . 73.310000000000002 111.416 -179.338 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.03 -50.03 72.09 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.025 -0.607 . . . . 73.099999999999994 112.553 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.41 -27.22 69.15 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.895 0.378 . . . . 71.209999999999994 111.295 -177.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.443 ' HB3' HD21 ' A' ' 83' ' ' LEU . 91.9 mt -69.82 -51.66 31.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.966 -0.561 . . . . 75.25 110.168 177.17 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.4 mt -65.44 -40.21 93.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.669 -0.696 . . . . 45.310000000000002 110.919 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -64.63 -47.56 78.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.993 0.425 . . . . 72.340000000000003 110.662 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.09 -25.75 75.18 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.984 -0.627 . . . . 44.340000000000003 113.058 -176.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.74 1.63 56.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.681 0.241 . . . . 51.240000000000002 111.46 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.2 t70 64.86 33.19 10.28 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 122.001 0.905 . . . . 71.25 110.287 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.803 HG23 ' HB3' ' A' ' 76' ' ' ASP . 71.5 mt -88.25 128.27 40.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.353 -0.839 . . . . 73.040000000000006 110.394 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.69 99.16 0.9 Allowed Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.812 -0.515 . . . . 44.109999999999999 111.812 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -122.7 152.52 40.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.778 0.323 . . . . 70.010000000000005 110.887 -173.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.0 tp -129.03 104.8 7.78 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.873 -0.603 . . . . 43.43 110.159 177.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.3 m -129.63 112.29 24.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.095 -0.502 . . . . 65.450000000000003 110.708 177.081 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.41 HD12 ' O ' ' A' ' 52' ' ' LEU . 2.7 pp -147.2 149.56 33.18 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.339 -0.392 . . . . 62.32 111.266 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -179.36 -160.7 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.127 -1.064 . . . . 74.319999999999993 108.127 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -122.63 127.86 49.91 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.888 -0.412 . . . . 73.109999999999999 109.888 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -78.16 137.44 38.17 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.43 -0.581 . . . . 75.230000000000004 109.43 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 54.6 ttp -49.56 -70.4 0.09 Allowed 'General case' 0 C--N 1.332 -0.177 0 O-C-N 123.713 0.633 . . . . 61.420000000000002 110.994 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.6 t 174.45 151.71 0.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 123.879 0.737 . . . . 74.129999999999995 109.4 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 14.3 tt -90.34 -13.93 9.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.64 0.733 . . . . 75.209999999999994 109.117 172.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 tp -101.57 98.9 9.16 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.332 -0.849 . . . . 73.230000000000004 110.333 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 68.34 -166.88 0.19 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.315 -0.857 . . . . 71.340000000000003 111.245 176.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.34 128.28 6.33 Favored Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.247 -0.741 . . . . 73.519999999999996 111.247 -174.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 31.5 m -72.09 -74.45 0.16 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.75 0.275 . . . . 71.25 111.004 -175.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 80.2 mt -135.29 119.0 17.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.923 0.392 . . . . 71.049999999999997 110.717 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.3 71.68 1.38 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.932 -0.652 . . . . 63.210000000000001 111.916 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.5 t -81.29 84.36 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.175 0.512 . . . . 64.150000000000006 110.743 -178.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 mp -110.79 112.47 56.02 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.694 -0.685 . . . . 64.420000000000002 109.588 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PRO . . . . . 0.513 ' HB3' ' HD3' ' A' ' 28' ' ' ARG . 22.3 Cg_exo -64.96 108.2 1.06 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.579 2.186 . . . . 72.340000000000003 111.308 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.534 ' HA ' ' CZ ' ' A' ' 68' ' ' ARG . 0.7 OUTLIER -97.35 138.11 35.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.219 -0.446 . . . . 74.230000000000004 110.723 -177.305 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.803 ' HD2' ' HG2' ' A' ' 25' ' ' GLU . 81.9 mtm180 -113.55 133.54 55.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.994 -0.548 . . . . 71.109999999999999 109.865 178.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.2 t -103.62 114.93 44.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.518 -0.549 . . . . 73.310000000000002 109.518 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.481 HD11 ' HG3' ' A' ' 25' ' ' GLU . 10.1 mp -103.59 144.18 31.77 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.851 0.358 . . . . 72.200000000000003 111.143 -177.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.504 HG23 HD22 ' A' ' 77' ' ' LEU . 26.2 m -141.5 167.27 16.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.682 -0.69 . . . . 75.450000000000003 109.811 176.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.505 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 14.1 m-70 -74.8 162.87 28.28 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.21 -0.663 . . . . 74.340000000000003 109.21 176.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.514 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 17.5 mt-10 -71.17 -18.62 62.48 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.214 -0.662 . . . . 74.409999999999997 109.214 174.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -66.87 -37.79 85.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.266 -0.879 . . . . 72.230000000000004 109.624 172.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.803 ' HB3' HG23 ' A' ' 47' ' ' ILE . 8.5 m-20 -97.45 -4.86 37.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.057 -0.974 . . . . 61.310000000000002 110.505 -175.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.612 ' O ' ' HG3' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -53.24 -58.26 7.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.837 -0.62 . . . . 73.219999999999999 111.233 -172.1 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.84 -32.72 72.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.801 0.334 . . . . 54.109999999999999 111.232 -177.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.76 -47.17 91.17 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.81 -0.709 . . . . 62.43 112.055 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.58 -40.8 80.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.504 0.193 . . . . 55.210000000000001 110.837 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.612 ' HG3' ' O ' ' A' ' 77' ' ' LEU . 21.0 mtp180 -57.36 -53.88 53.13 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.416 -0.357 . . . . 74.439999999999998 110.969 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -67.24 -37.55 83.71 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.833 -0.347 . . . . 64.019999999999996 110.864 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.443 HD21 ' HB3' ' A' ' 41' ' ' LEU . 60.6 tp -58.89 -54.94 41.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.072 0.463 . . . . 64.310000000000002 110.773 179.088 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.9 mt -66.09 -27.62 68.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.794 -0.639 . . . . 71.340000000000003 111.724 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.75 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 69.0 m -79.37 -42.7 24.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.768 0.318 . . . . 42.43 111.0 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.96 -43.91 70.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.997 -0.547 . . . . 60.030000000000001 112.261 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.49 23.72 4.39 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.397 0.517 . . . . 43.210000000000001 112.397 -175.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -121.01 -84.01 0.76 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.03 -1.081 . . . . 73.5 111.517 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.524 HD12 ' N ' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -178.35 -31.84 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.48 -0.36 . . . . 70.120000000000005 111.514 -175.832 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.75 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 59.36 24.58 13.16 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.818 0.342 . . . . 72.510000000000005 111.686 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.458 ' H ' ' CD1' ' A' ' 89' ' ' LEU . 59.1 t-80 -89.98 -22.76 21.76 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.337 -0.392 . . . . 71.129999999999995 111.164 -175.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -92.69 -8.32 44.3 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.291 -0.413 . . . . 43.130000000000003 111.686 -173.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.692 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.5 mp -70.42 94.59 0.97 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.148 0.499 . . . . 73.040000000000006 110.696 -176.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -137.7 27.45 2.74 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.757 -0.656 . . . . 74.430000000000007 111.739 -174.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 38.2 m -132.88 20.52 4.15 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.295 0.569 . . . . 45.109999999999999 110.893 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -92.45 116.5 29.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.717 -0.674 . . . . 64.400000000000006 111.055 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.6 t70 . . . . . 0 C--O 1.251 1.166 0 CA-C-N 115.817 -0.628 . . . . 75.200000000000003 109.866 176.438 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 mmt . . . . . 0 N--CA 1.482 1.139 0 CA-C-O 120.695 0.284 . . . . 52.329999999999998 110.263 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 118.91 112.81 2.49 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.882 -0.675 . . . . 71.049999999999997 112.128 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.7 t -128.96 95.74 4.16 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.981 0.42 . . . . 72.129999999999995 109.951 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.0 m -147.84 147.9 30.29 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.653 -0.703 . . . . 73.400000000000006 109.669 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -137.37 105.68 5.76 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.297 0.57 . . . . 73.409999999999997 110.698 178.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -102.62 119.59 39.09 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.781 -0.645 . . . . 74.519999999999996 109.868 177.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -71.9 87.84 1.02 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.21 -0.45 . . . . 70.400000000000006 110.064 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -75.99 150.3 37.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.065 -0.516 . . . . 73.319999999999993 110.851 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -171.2 101.83 0.21 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.127 -0.488 . . . . 71.409999999999997 110.182 176.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -100.03 152.55 20.08 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.184 -0.462 . . . . 65.120000000000005 110.034 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.2 p -84.87 164.63 18.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.348 -0.387 . . . . 75.129999999999995 110.792 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.3 m -114.22 121.18 42.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.918 0.39 . . . . 62.109999999999999 110.505 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -170.56 103.41 0.19 Allowed Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.294 -0.722 . . . . 44.109999999999999 111.294 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.8 ptt180 -119.17 141.64 48.67 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.933 0.397 . . . . 74.329999999999998 110.919 -176.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.39 121.58 15.85 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.784 -0.644 . . . . 75.109999999999999 109.594 178.293 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -150.68 94.6 2.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.458 -0.337 . . . . 72.239999999999995 110.889 -176.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.0 mp -135.58 91.68 2.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.35 -0.386 . . . . 73.420000000000002 110.755 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -105.41 109.7 21.77 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.34 -0.615 . . . . 75.25 109.34 172.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -66.89 -55.17 15.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.198 -0.455 . . . . 71.319999999999993 111.256 -174.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -107.86 134.4 50.85 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.878 0.37 . . . . 72.439999999999998 110.794 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.34 64.48 0.28 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 121.015 -0.612 . . . . 61.149999999999999 112.003 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -130.17 57.69 1.69 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.104 -0.702 . . . . 63.130000000000003 109.104 178.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.1 mt 67.99 168.12 0.26 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.169 -0.923 . . . . 51.329999999999998 110.508 -175.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.7 ' HB3' HD23 ' A' ' 77' ' ' LEU . 0.6 OUTLIER -143.84 127.19 16.77 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.766 -0.457 . . . . 74.319999999999993 109.766 -178.63 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.728 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 24.8 tt0 -68.38 117.87 10.72 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.096 -0.502 . . . . 74.540000000000006 109.646 178.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.729 HD12 HD23 ' A' ' 27' ' ' LEU . 2.7 tm? -93.64 -61.18 1.6 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.233 -0.44 . . . . 74.219999999999999 111.292 -171.172 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.729 HD23 HD12 ' A' ' 26' ' ' LEU . 2.6 pp -142.25 161.7 37.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.779 0.323 . . . . 62.219999999999999 111.063 -173.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -134.94 135.87 41.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.686 -0.688 . . . . 70.329999999999998 110.038 178.983 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.4 t -144.61 176.41 9.43 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.019 0.438 . . . . 62.219999999999999 110.943 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -117.72 -11.31 10.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.982 -0.553 . . . . 75.329999999999998 110.103 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.484 ' HA ' HD11 ' A' ' 63' ' ' LEU . 19.0 t70 -102.61 153.96 19.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.753 -0.658 . . . . 72.140000000000001 110.768 -176.432 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -111.59 -11.28 14.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.252 -0.431 . . . . 54.240000000000002 111.239 -178.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.9 t -78.52 -43.93 26.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.918 0.39 . . . . 73.140000000000001 110.482 -178.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.663 HD21 HD13 ' A' ' 89' ' ' LEU . 66.1 tp -60.32 -31.6 70.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.891 -0.595 . . . . 73.120000000000005 110.797 177.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 77.6 mt -62.4 -22.64 66.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.583 -0.735 . . . . 70.400000000000006 111.754 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.3 m -60.83 -45.03 96.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.846 0.355 . . . . 53.140000000000001 110.362 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.518 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -68.06 -41.61 81.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.289 -0.414 . . . . 72.299999999999997 110.616 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 56.8 t -60.02 -45.35 95.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.94 -0.573 . . . . 73.230000000000004 110.27 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.44 -44.62 96.47 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.602 -0.726 . . . . 63.140000000000001 112.151 -179.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.36 -33.62 72.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.852 0.358 . . . . 51.509999999999998 110.986 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 91.2 mt -72.09 -47.77 48.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.13 -0.486 . . . . 62.140000000000001 110.7 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 91.4 mt -65.72 -47.42 75.39 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.113 -0.494 . . . . 60.43 110.809 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -42.27 98.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 74.319999999999993 110.836 178.172 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.32 -35.56 87.95 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.231 -0.509 . . . . 71.450000000000003 112.868 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.84 -0.01 55.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.619 0.247 . . . . 72.519999999999996 111.095 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.5 t70 61.38 35.76 17.74 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.999 0.904 . . . . 65.439999999999998 110.232 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.672 HG23 ' HB3' ' A' ' 76' ' ' ASP . 64.9 mt -88.8 119.73 36.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.156 -0.929 . . . . 74.030000000000001 110.57 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.82 137.0 46.98 Favored Glycine 0 C--N 1.332 0.307 0 N-CA-C 111.528 -0.629 . . . . 61.229999999999997 111.528 175.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 38.9 p-80 -152.56 138.57 18.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.114 0.483 . . . . 73.540000000000006 111.68 -171.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.0 tt -126.87 103.93 7.77 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.503 -0.771 . . . . 34.549999999999997 109.163 177.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.4 t -80.86 117.85 27.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.85 -0.426 . . . . 63.140000000000001 109.85 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.423 ' HB3' ' HG3' ' A' ' 69' ' ' ARG . 5.9 tt -93.2 100.67 13.0 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.192 0.52 . . . . 71.549999999999997 110.243 -177.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -127.62 162.5 26.35 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.511 -0.922 . . . . 72.010000000000005 108.511 171.277 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.639 ' H ' HG21 ' A' ' 66' ' ' ILE . 26.2 tt0 -119.63 96.25 5.12 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.033 0.444 . . . . 73.010000000000005 110.4 -177.15 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -88.8 97.08 10.95 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.047 -0.524 . . . . 60.340000000000003 109.78 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 85.2 mtp -91.1 -169.99 2.52 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.829 -0.623 . . . . 54.020000000000003 110.456 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.1 m -61.04 156.29 18.23 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.789 -0.448 . . . . 71.329999999999998 109.789 174.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 7.1 tp -60.14 114.63 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.384 0.611 . . . . 64.319999999999993 111.275 -175.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 51.5 tp -151.69 155.06 37.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.503 -0.771 . . . . 51.450000000000003 109.003 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -66.87 126.86 30.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.1 0.476 . . . . 72.409999999999997 111.027 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.52 100.09 2.4 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.814 -0.707 . . . . 74.310000000000002 112.255 178.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.477 ' HA ' HD13 ' A' ' 66' ' ' ILE . 47.3 t -129.8 -46.92 1.15 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.866 0.365 . . . . 72.439999999999998 110.429 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.484 HD11 ' HA ' ' A' ' 31' ' ' ASP . 24.9 tp -86.71 125.97 34.25 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.544 -0.539 . . . . 75.420000000000002 109.544 -178.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.82 -45.53 3.49 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.938 -0.649 . . . . 71.510000000000005 111.908 -176.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -62.15 -36.04 72.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-O 121.178 0.513 . . . . 63.240000000000002 110.872 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.639 HG21 ' H ' ' A' ' 54' ' ' GLN . 3.5 mp -111.8 111.08 54.27 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 115.795 -0.639 . . . . 54.409999999999997 109.506 173.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -65.09 132.57 32.37 Favored 'Trans proline' 0 N--CA 1.463 -0.269 0 C-N-CA 122.518 2.145 . . . . 73.450000000000003 112.0 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 29.0 mmt-85 -101.84 113.33 26.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.192 -0.458 . . . . 75.519999999999996 109.838 -178.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.423 ' HG3' ' HB3' ' A' ' 52' ' ' LEU . 29.6 ptt180 -124.93 142.31 51.55 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.223 -0.591 . . . . 71.439999999999998 110.934 176.676 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.8 t -108.85 125.35 65.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.593 -0.73 . . . . 55.119999999999997 110.756 -174.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.728 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.0 mp -106.23 142.76 35.39 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.546 -0.538 . . . . 72.030000000000001 109.546 174.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.8 m -132.12 -178.41 2.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 109.847 -0.427 . . . . 55.149999999999999 109.847 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.587 ' HB2' ' HB2' ' A' ' 76' ' ' ASP . 24.9 m170 -68.49 158.12 34.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.817 0.341 . . . . 73.510000000000005 110.724 177.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -67.63 -38.78 84.39 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.221 -0.659 . . . . 73.030000000000001 109.221 174.482 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -73.4 -39.93 64.7 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.972 -1.013 . . . . 73.120000000000005 110.855 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.672 ' HB3' HG23 ' A' ' 47' ' ' ILE . 9.7 m-20 -78.34 -8.91 58.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.8 -0.636 . . . . 44.409999999999997 111.132 -178.391 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.757 HD12 ' HD3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -54.51 -46.2 73.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.041 0.448 . . . . 63.310000000000002 109.864 179.328 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.59 -36.64 79.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.506 -0.77 . . . . 63.119999999999997 111.357 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -78.49 -46.51 8.79 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.365 -0.921 . . . . 72.340000000000003 112.157 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.96 -47.9 73.08 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.911 0.337 . . . . 71.530000000000001 111.911 -175.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.757 ' HD3' HD12 ' A' ' 77' ' ' LEU . 15.5 ptt180 -68.56 -22.39 64.49 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.6 -0.44 . . . . 72.450000000000003 110.674 -176.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.4 ttp85 -78.2 -48.72 15.22 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.935 -0.395 . . . . 74.530000000000001 109.935 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 41.4 tp -59.56 -50.36 74.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.602 -0.726 . . . . 52.420000000000002 111.355 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.99 -27.87 68.47 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.929 -0.578 . . . . 73.25 111.917 -177.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.983 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 98.7 m -82.37 -37.35 25.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.791 0.329 . . . . 72.109999999999999 111.277 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -74.42 -44.69 50.73 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.944 0.349 . . . . 50.350000000000001 111.944 -176.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -142.95 35.65 1.39 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 111.851 0.315 . . . . 54.420000000000002 111.851 -174.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -124.63 -79.35 0.39 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.009 -1.091 . . . . 60.409999999999997 112.542 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.681 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -157.62 -56.66 0.08 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.756 0.313 . . . . 64.019999999999996 110.369 -175.099 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.983 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 63.75 12.71 6.87 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.421 -0.809 . . . . 52.340000000000003 112.703 177.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -105.39 -26.56 11.91 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.334 -0.547 . . . . 74.319999999999993 111.191 -176.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 28' ' ' ARG . 13.5 mm-40 -97.84 -3.21 39.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.087 0.47 . . . . 51.43 110.758 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.697 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.7 mp -73.21 135.31 44.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.148 -0.478 . . . . 62.200000000000003 110.636 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -156.86 91.3 1.2 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.326 0.584 . . . . 75.329999999999998 110.581 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.7 m -109.26 64.21 0.61 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.065 -0.717 . . . . 45.450000000000003 109.065 175.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 65.36 14.17 9.27 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.429 -0.805 . . . . 73.439999999999998 110.061 -172.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.9 t70 . . . . . 0 C--O 1.25 1.126 0 CA-C-N 114.53 -1.214 . . . . 74.010000000000005 108.938 178.768 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ttt . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 120.889 0.376 . . . . 71.140000000000001 110.22 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 156.49 155.09 7.27 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 111.368 -0.693 . . . . 44.109999999999999 111.368 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.5 m -153.49 92.89 1.63 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.96 0.41 . . . . 70.329999999999998 110.639 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.2 p -107.83 66.93 0.67 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.453 0.644 . . . . 50.119999999999997 110.327 178.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -156.14 131.35 9.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.329 -0.85 . . . . 72.519999999999996 109.475 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -148.36 152.97 37.95 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.53 -0.304 . . . . 70.319999999999993 110.891 -177.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.6 t-80 -156.53 81.25 0.96 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.491 -0.559 . . . . 74.049999999999997 109.491 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -154.78 76.69 1.01 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.055 -0.52 . . . . 74.319999999999993 110.475 -175.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -177.11 114.17 0.09 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.349 -0.387 . . . . 61.229999999999997 110.962 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -163.58 17.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.026 0.441 . . . . 74.209999999999994 110.618 170.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.9 m -79.97 106.69 12.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.378 -0.373 . . . . 72.400000000000006 110.433 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.0 m -158.07 130.43 7.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.204 -0.453 . . . . 74.340000000000003 110.516 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 123.62 50.7 0.21 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.223 -0.989 . . . . 55.200000000000003 113.261 175.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -102.09 88.89 3.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.955 0.407 . . . . 75.109999999999999 110.512 174.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -123.62 -5.15 8.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.875 -0.602 . . . . 64.519999999999996 110.662 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -90.29 101.03 13.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.285 -0.416 . . . . 73.530000000000001 110.082 176.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -134.91 104.27 5.92 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.014 -0.735 . . . . 71.329999999999998 109.014 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 43.3 p90 -148.14 143.77 27.33 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.924 -0.58 . . . . 74.150000000000006 110.123 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -140.74 136.91 33.02 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.931 -0.577 . . . . 71.329999999999998 109.796 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -129.0 -34.88 1.88 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.355 0.598 . . . . 72.129999999999995 109.58 178.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.18 26.37 8.36 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.368 -0.833 . . . . 43.310000000000002 111.045 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -113.62 165.12 12.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.805 0.336 . . . . 74.439999999999998 110.781 -173.36 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.4 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.1 mp -99.03 157.85 16.06 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.679 -0.489 . . . . 73.239999999999995 109.679 175.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 ttt180 -134.52 133.31 40.19 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.78 -0.452 . . . . 74.219999999999999 109.78 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.567 ' CA ' ' HG ' ' A' ' 71' ' ' LEU . 1.8 pt-20 -73.28 127.7 33.38 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.097 -0.705 . . . . 71.519999999999996 109.097 -179.04 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 45.3 tp -104.54 -29.84 10.4 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.579 -0.737 . . . . 65.439999999999998 111.132 -171.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.403 ' CD2' ' HB ' ' A' ' 70' ' ' VAL . 1.6 pt? -163.73 158.67 20.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.045 0.45 . . . . 75.129999999999995 111.253 -176.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -145.8 128.33 16.04 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.567 -0.901 . . . . 73.400000000000006 108.567 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.5 t -143.09 162.15 36.29 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.391 0.615 . . . . 73.040000000000006 111.698 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -106.77 2.03 25.33 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.256 -0.884 . . . . 65.5 110.414 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -96.54 119.9 35.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.981 -0.554 . . . . 75.319999999999993 109.822 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.32 -45.94 68.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.181 -0.463 . . . . 74.019999999999996 111.981 -174.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.2 t -66.51 -46.63 85.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.396 -0.365 . . . . 61.25 111.009 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.8 tp -61.59 -41.5 97.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.766 0.317 . . . . 71.140000000000001 110.396 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.43 HD11 ' HB3' ' A' ' 68' ' ' ARG . 4.7 tt -59.46 -44.55 92.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.937 -0.574 . . . . 61.210000000000001 110.011 177.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.8 m -65.31 -41.54 93.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.868 -0.605 . . . . 71.319999999999993 110.711 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.43 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -62.01 -51.87 66.27 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.084 -0.507 . . . . 61.310000000000002 111.087 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.457 ' HA ' HD12 ' A' ' 41' ' ' LEU . 99.2 t -63.81 -40.46 89.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.089 0.471 . . . . 74.409999999999997 110.927 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.34 -42.24 99.72 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.796 -0.638 . . . . 54.329999999999998 112.297 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.08 -34.03 77.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.805 0.336 . . . . 63.0 110.825 178.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.551 ' HB3' HD21 ' A' ' 83' ' ' LEU . 97.8 mt -62.43 -49.1 76.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.285 0.564 . . . . 73.510000000000005 110.5 177.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.539 HD12 HG11 ' A' ' 70' ' ' VAL . 75.3 mt -70.94 -42.53 69.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.578 -0.737 . . . . 63.310000000000002 111.044 -176.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -67.13 -35.53 79.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.953 0.406 . . . . 64.430000000000007 110.627 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.1 -23.05 72.87 Favored Glycine 0 C--O 1.229 -0.194 0 C-N-CA 121.027 -0.606 . . . . 64.129999999999995 112.281 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.19 11.78 20.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.929 0.395 . . . . 33.530000000000001 110.528 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.0 t70 68.63 6.26 5.37 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.309 -0.86 . . . . 72.340000000000003 111.294 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 60.6 mt -73.6 -24.19 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.648 0.737 . . . . 50.229999999999997 109.042 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.05 -153.43 51.16 Favored Glycine 0 N--CA 1.441 -1.014 0 CA-C-N 114.779 -1.1 . . . . 55.030000000000001 111.573 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -173.15 143.39 1.12 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.654 0.264 . . . . 75.340000000000003 110.702 176.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.897 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 41.8 tp -108.45 88.28 2.69 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 108.781 -0.822 . . . . 62.210000000000001 108.781 168.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.539 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 24.0 m -108.0 25.21 2.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.974 0.893 . . . . 52.32 109.644 -178.719 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 39.1 tp -110.94 80.18 1.28 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.817 -1.083 . . . . 72.439999999999998 110.468 -173.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.405 ' HB3' ' H ' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -107.34 -152.52 0.48 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.344 -0.844 . . . . 61.140000000000001 109.713 175.646 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.405 ' H ' ' HB3' ' A' ' 53' ' ' ASP . 58.1 tt0 -64.58 112.52 3.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.071 0.462 . . . . 72.329999999999998 110.996 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -98.86 172.37 7.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.742 -0.663 . . . . 74.219999999999999 110.809 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.437 ' SD ' ' N ' ' A' ' 57' ' ' SER . 0.0 OUTLIER -153.07 161.38 42.56 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.092 -1.077 . . . . 71.030000000000001 108.092 178.793 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.437 ' N ' ' SD ' ' A' ' 56' ' ' MET . 3.8 m -62.01 -82.24 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.871 0.367 . . . . 64.329999999999998 111.31 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.412 ' H ' ' HB2' ' A' ' 57' ' ' SER . 5.3 mp -134.78 -49.91 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 75.329999999999998 109.949 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.4 tt 59.76 66.41 1.0 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.376 -0.829 . . . . 63.229999999999997 110.132 -177.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 71.08 -35.17 0.32 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.741 0.816 . . . . 73.299999999999997 112.805 177.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.91 70.43 1.28 Allowed Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.787 -0.72 . . . . 74.219999999999999 111.572 -179.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 39.5 m -148.52 -62.58 0.25 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.818 0.342 . . . . 64.549999999999997 110.705 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 50.8 tp -147.72 145.15 28.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.469 . . . . 74.310000000000002 110.387 -176.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -89.06 131.99 11.0 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.743 -0.741 . . . . 72.319999999999993 111.587 176.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.5 t -65.62 -40.85 89.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.387 0.613 . . . . 74.120000000000005 110.262 -179.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 50.4 mm -107.7 103.78 50.58 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.24 -0.891 . . . . 64.010000000000005 109.591 176.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -62.23 124.69 14.8 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.619 2.213 . . . . 72.450000000000003 111.421 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.43 ' HB3' HD11 ' A' ' 35' ' ' LEU . 50.3 ttm-85 -62.03 136.91 58.16 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.058 -0.519 . . . . 64.120000000000005 109.997 -178.759 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 32.0 ptt180 -122.18 157.59 31.23 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.444 -0.343 . . . . 73.030000000000001 110.476 -175.09 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.539 HG11 HD12 ' A' ' 42' ' ' LEU . 24.7 t -112.53 116.32 52.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.833 -0.621 . . . . 62.210000000000001 110.393 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.897 ' HB2' ' HB3' ' A' ' 50' ' ' LEU . 8.9 mp -101.99 129.58 48.32 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.08 -0.509 . . . . 63.340000000000003 110.288 176.207 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 29.5 m -108.94 -173.68 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.585 -0.734 . . . . 52.229999999999997 109.571 177.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -97.59 143.71 28.0 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.839 -0.344 . . . . 74.019999999999996 110.621 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -40.19 -54.61 2.3 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.373 1.249 . . . . 54.43 114.373 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -80.8 -19.07 45.53 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.063 0.458 . . . . 73.450000000000003 111.196 -171.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -83.2 2.24 36.66 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.832 -0.622 . . . . 75.430000000000007 110.783 -177.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -54.89 -44.65 74.31 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.424 -0.353 . . . . 54.240000000000002 110.673 176.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.37 83.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.99 -0.55 . . . . 41.439999999999998 111.177 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -69.1 -46.7 57.48 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.661 -0.781 . . . . 41.310000000000002 111.862 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.21 96.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.681 -0.259 . . . . 73.219999999999999 111.582 -178.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 55.2 mtp85 -59.0 -48.64 80.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.998 -0.547 . . . . 64.409999999999997 111.357 -178.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -64.58 -45.69 85.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.989 0.423 . . . . 62.049999999999997 110.564 179.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.551 HD21 ' HB3' ' A' ' 41' ' ' LEU . 59.4 tp -55.67 -55.58 30.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.283 -0.872 . . . . 74.120000000000005 111.802 -175.484 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 68.7 mt -69.21 -32.06 71.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.243 -0.435 . . . . 71.129999999999995 111.745 -176.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 82.5 m -72.35 -44.84 62.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.599 0.238 . . . . 70.109999999999999 111.218 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -69.73 -25.65 63.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.032 0.444 . . . . 64.0 110.542 -178.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.66 -10.48 59.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.965 -0.562 . . . . 72.109999999999999 110.941 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 72.94 30.35 63.54 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.222 -0.513 . . . . 34.100000000000001 112.73 178.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.4 mt -118.29 17.74 13.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.055 0.455 . . . . 72.340000000000003 111.057 -178.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.632 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -77.83 85.43 4.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.252 -0.431 . . . . 60.439999999999998 110.29 178.396 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -141.18 -40.37 0.39 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.826 -0.624 . . . . 71.109999999999999 110.657 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -88.34 -1.28 57.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.463 -0.335 . . . . 73.319999999999993 111.349 -177.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.632 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.1 mp -65.97 118.42 9.74 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.998 -0.371 . . . . 64.310000000000002 109.998 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.54 18.28 15.11 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.718 -0.393 . . . . 73.239999999999995 111.597 -172.443 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 19.5 m -73.27 -22.81 60.3 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.327 -0.249 . . . . 63.039999999999999 110.327 176.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 25.6 t70 75.53 -44.44 0.52 Allowed 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.889 0.876 . . . . 73.209999999999994 111.718 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 C--O 1.252 1.184 0 CA-C-O 118.575 -0.726 . . . . 74.540000000000006 109.859 176.346 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.5 ttp . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.002 -0.37 . . . . 72.140000000000001 110.002 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -172.46 45.38 0.17 Allowed Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.611 -0.596 . . . . 63.229999999999997 111.611 -179.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.6 p -88.07 83.4 7.01 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.214 0.531 . . . . 65.25 111.064 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t -124.2 113.84 18.84 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.108 -0.701 . . . . 62.200000000000003 109.108 179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -104.6 117.25 33.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.507 -0.315 . . . . 70.329999999999998 110.267 -175.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -145.63 105.67 4.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.179 -0.464 . . . . 75.340000000000003 109.862 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -168.23 32.92 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.306 0.575 . . . . 71.519999999999996 109.664 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 -80.66 129.51 34.56 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.774 -0.648 . . . . 70.430000000000007 110.886 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -141.1 107.73 5.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.274 -0.421 . . . . 61.149999999999999 110.754 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.464 ' HA ' ' OD2' ' A' ' 46' ' ' ASP . 55.8 t-80 -60.98 107.67 0.75 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.932 -0.576 . . . . 75.319999999999993 110.799 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.403 ' H ' ' HB3' ' A' ' 46' ' ' ASP . 16.4 m -116.9 -1.01 12.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.122 0.487 . . . . 54.409999999999997 111.067 -178.152 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.6 p -87.52 88.99 7.83 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.243 0.544 . . . . 63.149999999999999 110.779 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -122.42 63.9 0.52 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.651 -0.785 . . . . 33.130000000000003 112.844 -177.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -163.03 111.18 1.26 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.982 0.42 . . . . 74.530000000000001 111.742 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.19 102.86 8.19 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.416 -0.957 . . . . 63.210000000000001 108.416 169.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.445 ' HB3' HD12 ' A' ' 17' ' ' LEU . 65.3 t30 -116.2 -21.77 9.21 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.205 -0.452 . . . . 75.420000000000002 111.881 -167.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.445 HD12 ' HB3' ' A' ' 16' ' ' ASN . 5.3 mp -111.46 -158.61 0.65 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.74 -0.467 . . . . 53.409999999999997 109.74 -175.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -162.2 128.36 3.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.247 -0.433 . . . . 74.329999999999998 110.052 173.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.476 ' HD2' ' HB3' ' A' ' 74' ' ' GLU . 85.5 t80 -130.76 134.48 46.92 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.122 -0.49 . . . . 63.43 109.847 177.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -78.55 111.63 14.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.502 0.668 . . . . 62.439999999999998 110.782 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 152.98 -156.68 26.86 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 110.49 -1.044 . . . . 51.119999999999997 110.49 -178.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.476 ' HB3' HD12 ' A' ' 23' ' ' LEU . 35.3 m80 -138.42 -88.09 0.24 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.322 0.561 . . . . 73.549999999999997 110.774 175.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.476 HD12 ' HB3' ' A' ' 22' ' ' HIS . 6.6 mp -114.78 140.93 48.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.816 0.341 . . . . 72.439999999999998 110.893 -178.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -127.41 155.77 43.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.837 -0.62 . . . . 70.25 110.957 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.845 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 42.7 tt0 -74.92 117.4 16.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.98 -0.555 . . . . 64.530000000000001 110.378 -179.168 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 26' ' ' LEU . 10.0 mt -86.1 -45.34 11.48 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.069 -0.514 . . . . 73.219999999999999 111.566 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.1 tp -140.04 139.77 36.03 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.084 -0.507 . . . . 73.219999999999999 111.262 -165.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -115.49 94.94 4.92 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.331 -0.85 . . . . 73.239999999999995 108.712 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.423 ' O ' ' HB3' ' A' ' 68' ' ' ARG . 43.0 m -137.74 104.74 5.39 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.247 0.546 . . . . 73.25 112.403 -169.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -89.74 -1.05 57.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.246 0.546 . . . . 73.299999999999997 109.727 174.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -68.88 -33.98 74.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.142 -0.936 . . . . 75.209999999999994 111.682 -176.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 73.23 -50.85 0.7 Allowed 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.663 0.785 . . . . 75.219999999999999 112.096 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 56.3 t -66.64 -49.15 77.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.689 0.28 . . . . 62.020000000000003 110.521 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.5 tp -56.93 -38.29 72.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.197 0.522 . . . . 75.099999999999994 110.287 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.404 ' O ' HD23 ' A' ' 35' ' ' LEU . 6.0 tt -63.69 -32.75 74.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 74.540000000000006 110.562 -179.416 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.7 m -61.83 -37.04 82.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.995 0.426 . . . . 61.310000000000002 110.888 -179.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.3 -42.99 74.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 73.230000000000004 110.649 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 85.1 t -67.14 -42.49 88.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.008 -0.542 . . . . 74.420000000000002 110.612 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.96 -35.03 89.96 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.773 -0.649 . . . . 44.310000000000002 112.486 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -32.89 74.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.708 0.289 . . . . 63.109999999999999 110.796 178.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.3 mt -69.31 -49.5 55.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.462 . . . . 71.209999999999994 110.477 178.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.566 ' HA ' HD12 ' A' ' 47' ' ' ILE . 76.2 mt -62.75 -55.16 29.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.703 -0.68 . . . . 64.109999999999999 111.077 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.37 -25.07 67.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 64.209999999999994 111.214 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.53 -30.65 75.11 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 121.062 -0.589 . . . . 74.219999999999999 112.431 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -109.76 8.16 24.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.963 0.411 . . . . 53.310000000000002 110.63 178.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.464 ' OD2' ' HA ' ' A' ' 10' ' ' HIS . 26.2 t0 56.52 43.24 26.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 122.021 0.915 . . . . 63.549999999999997 110.623 -175.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.566 HD12 ' HA ' ' A' ' 42' ' ' LEU . 68.0 mt -67.66 -27.46 38.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 114.949 -1.023 . . . . 71.329999999999998 109.816 174.07 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.56 -178.79 35.52 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.163 -0.926 . . . . 73.439999999999998 111.468 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -165.81 125.31 1.69 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.018 0.437 . . . . 75.510000000000005 111.618 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.671 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 61.7 tp -105.88 100.14 9.7 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 107.988 -1.115 . . . . 73.329999999999998 107.988 166.186 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.434 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 21.9 m -116.55 172.64 4.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.473 -0.331 . . . . 50.340000000000003 111.755 -172.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 52' ' ' LEU . 4.2 mm? 68.08 -169.73 0.19 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.414 -0.812 . . . . 70.530000000000001 111.648 178.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -158.91 -38.65 0.06 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.349 -0.841 . . . . 73.200000000000003 109.052 -176.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 23.1 tm0? -147.04 135.6 21.95 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.075 -1.083 . . . . 53.240000000000002 108.075 172.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -103.07 122.86 45.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.11 0.481 . . . . 72.319999999999993 111.671 -173.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.8 ptt? -152.69 -171.71 4.02 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.8 -0.636 . . . . 75.219999999999999 109.358 177.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.9 m -63.24 138.32 58.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.871 0.367 . . . . 72.510000000000005 110.631 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.6 tt -78.15 128.75 38.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.148 0.499 . . . . 51.399999999999999 111.229 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 59' ' ' LEU . 1.2 tm? -141.94 125.14 16.4 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.506 -0.924 . . . . 65.140000000000001 108.506 177.445 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -127.63 178.97 5.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.875 0.369 . . . . 71.040000000000006 110.984 -176.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 138.73 -115.89 1.2 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.433 -0.667 . . . . 60.140000000000001 111.433 -177.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.3 m -118.69 82.0 1.78 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.94 0.4 . . . . 71.349999999999994 110.262 177.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.408 ' HG ' HG23 ' A' ' 65' ' ' VAL . 25.9 tp -175.78 97.44 0.07 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.885 -0.598 . . . . 75.200000000000003 109.844 -177.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -105.72 64.33 0.3 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.634 -0.793 . . . . 64.030000000000001 111.998 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.408 HG23 ' HG ' ' A' ' 63' ' ' LEU . 64.8 t -90.16 -32.18 5.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 120.878 0.371 . . . . 52.439999999999998 110.681 -178.151 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.406 HD12 ' N ' ' A' ' 66' ' ' ILE . 3.8 mp -98.89 107.9 46.06 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.124 -0.489 . . . . 64.310000000000002 110.333 -179.094 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -82.5 104.96 1.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 122.3 2.0 . . . . 65.430000000000007 111.41 176.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 29' ' ' THR . 24.0 ttm180 -72.97 117.85 15.2 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.268 -0.642 . . . . 73.109999999999999 109.268 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.434 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 8.9 ptp85 -113.84 134.48 54.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.783 -0.644 . . . . 72.140000000000001 111.236 -172.23 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 24.4 t -101.71 127.43 55.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.896 -0.593 . . . . 72.400000000000006 110.526 174.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.845 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.9 mp -121.66 147.68 45.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.794 -0.185 . . . . 63.329999999999998 111.115 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.515 HG23 HD22 ' A' ' 77' ' ' LEU . 35.7 m -134.67 178.76 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 109.441 -0.577 . . . . 72.530000000000001 109.441 173.489 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 23' ' ' LEU . 7.4 p80 -96.65 177.14 5.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.73 0.3 . . . . 63.310000000000002 111.635 -174.403 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.476 ' HB3' ' HD2' ' A' ' 19' ' ' PHE . 0.0 OUTLIER -67.24 169.43 8.73 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.142 -0.481 . . . . 61.109999999999999 111.855 -178.857 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.1 t70 66.77 -65.39 0.21 Allowed 'General case' 0 N--CA 1.471 0.587 0 O-C-N 124.03 0.831 . . . . 64.319999999999993 109.877 -174.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -54.32 -26.56 30.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.677 -1.147 . . . . 70.420000000000002 111.164 176.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.515 HD22 HG23 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -50.03 -40.66 45.55 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.798 -0.637 . . . . 62.240000000000002 110.554 178.357 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.52 -41.46 69.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 54.109999999999999 110.872 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.23 -45.33 81.59 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.085 -0.579 . . . . 74.349999999999994 112.145 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.34 93.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.653 0.263 . . . . 75.150000000000006 110.855 178.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 30.1 mtp180 -60.2 -48.71 80.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.448 -0.342 . . . . 75.340000000000003 110.717 177.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -59.34 -40.52 86.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.062 -0.517 . . . . 73.319999999999993 110.688 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 42.0 tp -61.79 -49.45 76.31 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.888 -0.596 . . . . 73.299999999999997 110.809 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.6 mp -68.28 -29.03 67.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.088 -0.505 . . . . 51.039999999999999 111.4 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 51.1 m -69.56 -45.27 69.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.764 0.316 . . . . 53.219999999999999 110.251 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -62.4 -36.93 83.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 74.129999999999995 110.832 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.26 -18.09 60.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.92 -0.582 . . . . 74.099999999999994 111.153 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 83.02 23.37 55.53 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.123 -0.56 . . . . 55.140000000000001 113.02 177.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.1 mt -107.01 -3.03 20.51 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 122.541 -0.388 . . . . 51.32 111.186 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.781 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -75.56 86.23 2.65 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.352 -0.385 . . . . 61.240000000000002 111.152 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -147.16 -43.26 0.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.113 -0.494 . . . . 64.409999999999997 110.757 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -91.75 18.53 7.51 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.35 0.595 . . . . 60.299999999999997 110.69 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.781 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.7 mp -82.18 167.02 19.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.66 -0.7 . . . . 73.439999999999998 111.525 -177.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.597 ' HD2' ' OE1' ' A' ' 25' ' ' GLU . 28.0 ttt180 -103.06 94.49 5.57 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.471 -0.786 . . . . 71.319999999999993 109.4 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.466 ' O ' ' HB2' ' A' ' 96' ' ' ASP . 38.2 m -127.69 86.9 2.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 111.922 0.342 . . . . 63.009999999999998 111.922 -175.148 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' A' ' 95' ' ' SER . 30.1 t70 165.95 -40.5 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 O-C-N 124.328 1.018 . . . . 72.400000000000006 109.7 172.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.257 -0.878 . . . . 70.049999999999997 110.44 -178.735 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mpp? . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 110.085 -0.339 . . . . 72.109999999999999 110.085 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -174.17 70.15 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.998 -0.62 . . . . 71.019999999999996 111.839 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 m -106.94 26.18 10.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.976 0.417 . . . . 53.399999999999999 110.395 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.2 m -92.1 112.33 24.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.462 0.649 . . . . 55.439999999999998 111.525 -175.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.1 m170 -118.84 113.21 20.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.598 -0.728 . . . . 73.430000000000007 109.724 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -110.52 115.3 29.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.06 0.457 . . . . 74.019999999999996 109.903 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.4 p80 -151.76 134.74 15.74 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.973 -0.558 . . . . 73.349999999999994 110.429 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -150.97 123.66 8.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.833 -0.621 . . . . 73.0 110.086 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.76 88.54 1.41 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.355 -0.384 . . . . 71.230000000000004 110.551 -175.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -164.25 134.11 4.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.277 -0.638 . . . . 72.219999999999999 109.277 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.2 m -157.61 110.74 2.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.639 0.257 . . . . 63.539999999999999 111.282 -178.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 p -166.23 143.72 5.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 42.43 110.441 174.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 150.04 108.4 0.44 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.89 -0.672 . . . . 74.25 112.114 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 -173.41 -60.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.985 0.421 . . . . 72.099999999999994 110.383 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -70.9 130.91 42.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.438 -0.801 . . . . 72.120000000000005 111.816 -172.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -126.31 149.12 49.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.423 -0.808 . . . . 73.129999999999995 109.312 175.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 75.8 mt -147.13 116.41 6.97 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.603 -0.271 . . . . 70.109999999999999 111.485 -175.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 21.5 p90 -157.75 137.3 12.04 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.274 -0.421 . . . . 74.340000000000003 110.193 173.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.775 ' HB2' ' HA ' ' A' ' 75' ' ' ASP . 96.6 m-85 -129.09 128.87 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.695 -0.684 . . . . 75.239999999999995 109.876 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -89.8 131.27 35.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.128 0.49 . . . . 51.32 111.069 -176.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 164.82 -164.49 37.0 Favored Glycine 0 N--CA 1.443 -0.867 0 N-CA-C 111.236 -0.746 . . . . 61.020000000000003 111.236 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.41 ' HB3' ' H ' ' A' ' 23' ' ' LEU . 6.3 t-80 -134.63 -100.79 0.24 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.84 -0.43 . . . . 71.549999999999997 109.84 177.456 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.553 HD21 HD13 ' A' ' 50' ' ' LEU . 5.7 mp -143.33 120.56 11.52 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.149 -0.315 . . . . 74.329999999999998 110.149 176.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 24' ' ' ARG . 50.6 mtm180 -111.34 170.32 8.2 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.996 -0.372 . . . . 74.439999999999998 109.996 173.102 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.669 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 36.6 tt0 -81.82 135.06 35.47 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.79 0.329 . . . . 72.049999999999997 111.29 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.837 HD21 HG22 ' A' ' 72' ' ' VAL . 4.4 mm? -97.23 -67.19 0.86 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.056 -0.52 . . . . 71.340000000000003 110.034 175.317 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.633 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -142.82 157.9 44.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.24 -0.437 . . . . 72.430000000000007 110.559 177.938 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -138.01 101.73 4.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.828 -0.804 . . . . 63.509999999999998 108.828 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.0 t -113.59 170.25 8.38 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.242 -0.436 . . . . 74.310000000000002 110.525 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 68.8 m-20 -104.57 -3.78 23.42 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.066 0.46 . . . . 74.530000000000001 109.768 177.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -105.98 156.71 18.1 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.734 -0.666 . . . . 73.430000000000007 111.174 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.73 -15.13 11.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.199 -0.455 . . . . 73.109999999999999 110.999 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 82.5 t -71.75 -49.51 45.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.007 0.432 . . . . 74.040000000000006 110.744 -177.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.4 tp -59.86 -31.78 70.09 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.886 -0.597 . . . . 72.109999999999999 110.684 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 76.3 mt -67.58 -22.98 65.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.506 . . . . 73.200000000000003 111.54 -178.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.6 m -67.97 -36.9 80.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.007 0.432 . . . . 73.129999999999995 110.238 176.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -72.18 -45.35 60.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 74.109999999999999 110.317 177.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.7 t -63.81 -42.77 96.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.76 -0.654 . . . . 61.549999999999997 110.972 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.35 -37.42 94.03 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.816 -0.629 . . . . 62.229999999999997 112.239 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.42 -31.3 72.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.758 0.314 . . . . 75.25 111.006 178.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 91.0 mt -70.42 -51.02 32.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.959 0.409 . . . . 73.129999999999995 110.159 177.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.672 ' HA ' HD12 ' A' ' 47' ' ' ILE . 48.3 mt -58.67 -52.87 63.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.602 -0.726 . . . . 72.319999999999993 110.969 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -67.75 -34.35 76.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.601 -0.727 . . . . 54.130000000000003 111.168 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.62 -15.2 61.51 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 116.12 -0.491 . . . . 63.25 112.443 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -100.76 -65.58 0.96 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.563 0.221 . . . . 64.329999999999998 110.609 176.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.0 t70 164.37 -19.78 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.402 -0.817 . . . . 73.329999999999998 109.09 -173.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.672 HD12 ' HA ' ' A' ' 42' ' ' LEU . 23.9 mt -51.04 106.41 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 114.179 -1.373 . . . . 74.219999999999999 112.869 -166.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.59 114.16 6.44 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.414 -0.812 . . . . 40.109999999999999 111.274 173.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -127.34 130.45 49.47 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.931 0.396 . . . . 75.319999999999993 110.647 -173.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.553 HD13 HD21 ' A' ' 23' ' ' LEU . 8.7 mp -106.66 112.16 25.02 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.858 -0.61 . . . . 75.319999999999993 110.05 179.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 m -94.97 104.69 16.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.86 -0.609 . . . . 64.450000000000003 110.512 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.2 tt -102.18 124.86 48.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.847 -0.615 . . . . 63.219999999999999 110.563 -175.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.67 ' HB3' ' HE ' ' A' ' 68' ' ' ARG . 3.6 p30 -129.36 152.34 49.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.927 -0.579 . . . . 72.340000000000003 109.782 173.628 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.626 ' HB2' ' HB ' ' A' ' 66' ' ' ILE . 60.4 mt-30 -131.83 28.51 4.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.64 0.257 . . . . 72.299999999999997 111.342 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -75.15 102.36 4.91 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.907 -0.775 . . . . 73.319999999999993 108.907 174.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 62.2 mtm -76.34 -74.59 0.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.733 -0.667 . . . . 75.239999999999995 111.943 -170.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.3 m -99.38 128.31 45.49 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.249 -0.432 . . . . 70.0 110.398 -175.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 8.7 tt -117.75 101.06 11.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.711 0.767 . . . . 71.019999999999996 110.834 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.9 tp -92.63 -31.98 14.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.526 -0.761 . . . . 71.439999999999998 109.291 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -158.36 -44.89 0.06 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.796 -1.093 . . . . 74.040000000000006 108.303 177.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.56 -53.8 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.525 -0.761 . . . . 62.43 111.733 177.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 67.7 m 70.77 167.14 0.3 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.288 0.635 . . . . 71.420000000000002 112.084 178.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -90.89 92.3 8.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.931 -0.577 . . . . 44.219999999999999 110.132 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.5 98.76 1.05 Allowed Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.684 -0.769 . . . . 61.420000000000002 111.754 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 31.9 t -57.19 -45.64 84.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.457 0.646 . . . . 60.32 109.846 177.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.626 ' HB ' ' HB2' ' A' ' 54' ' ' GLN . 4.2 mp -113.56 91.66 21.3 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.273 -0.876 . . . . 74.430000000000007 108.67 171.134 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -65.89 -69.39 0.03 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.797 2.332 . . . . 71.319999999999993 111.76 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.67 ' HE ' ' HB3' ' A' ' 53' ' ' ASP . 0.7 OUTLIER -158.08 116.63 3.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.11 -0.495 . . . . 75.340000000000003 110.367 175.778 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -113.91 132.41 55.94 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.739 -0.664 . . . . 75.109999999999999 109.33 177.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.402 ' C ' HD12 ' A' ' 71' ' ' LEU . 52.2 t -109.74 118.49 56.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.405 -0.361 . . . . 61.219999999999999 110.448 -177.041 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.669 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.5 mp -125.74 144.37 50.65 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.996 -0.547 . . . . 62.200000000000003 109.914 177.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.837 HG22 HD21 ' A' ' 26' ' ' LEU . 33.2 m -127.68 165.66 26.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.931 -0.396 . . . . 75.340000000000003 109.931 177.098 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.488 ' ND1' ' HB3' ' A' ' 75' ' ' ASP . 0.4 OUTLIER -69.59 133.82 48.06 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.582 -0.281 . . . . 62.539999999999999 110.504 178.307 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.481 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 43.7 mm-40 -51.5 -28.46 13.55 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.137 0.575 . . . . 72.549999999999997 111.945 -177.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.775 ' HA ' ' HB2' ' A' ' 19' ' ' PHE . 34.9 t70 -58.4 -17.7 22.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.453 -0.794 . . . . 71.0 112.124 -179.138 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -131.59 13.24 4.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.157 0.503 . . . . 71.510000000000005 109.928 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -57.3 -51.21 70.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.983 -0.553 . . . . 73.099999999999994 110.883 -174.441 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.16 -36.2 82.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.904 -0.589 . . . . 54.32 111.459 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.61 -47.39 21.32 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.627 -0.797 . . . . 71.230000000000004 111.956 -179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.05 -44.67 87.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.691 0.256 . . . . 71.400000000000006 111.691 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -59.68 -49.13 78.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.695 -0.229 . . . . 63.229999999999997 111.575 -177.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -65.56 -35.28 80.39 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.424 -0.51 . . . . 72.400000000000006 110.712 -178.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.2 tp -61.97 -43.07 99.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.932 0.396 . . . . 75.329999999999998 110.211 178.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.73 -28.54 66.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.0 -0.546 . . . . 74.310000000000002 111.236 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.41 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 19.2 m -77.33 -48.81 16.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.164 0.507 . . . . 64.010000000000005 110.781 176.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.04 -44.39 76.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.167 -0.924 . . . . 65.019999999999996 112.122 -171.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -123.06 28.3 7.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.89 0.376 . . . . 44.43 111.747 -175.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -139.96 -80.98 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.103 -1.046 . . . . 73.540000000000006 112.252 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.54 HD13 ' OE1' ' A' ' 92' ' ' GLU . 0.6 OUTLIER -179.12 -57.12 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 122.321 0.248 . . . . 63.009999999999998 111.187 -173.434 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.988 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . 60.12 20.99 10.24 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.025 0.53 . . . . 74.439999999999998 112.055 -177.048 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' HIS . . . . . 0.476 ' H ' HD12 ' A' ' 89' ' ' LEU . 57.1 t-80 -100.67 -29.27 12.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.089 0.471 . . . . 73.129999999999995 110.651 -176.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.54 ' OE1' HD13 ' A' ' 89' ' ' LEU . 5.4 mp0 -94.75 6.96 47.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.823 -0.626 . . . . 75.450000000000003 110.701 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.988 HD13 ' HA ' ' A' ' 90' ' ' ALA . 11.1 mp -73.13 150.61 42.08 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.205 -0.452 . . . . 74.150000000000006 110.701 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 94' ' ' ARG . 22.3 ttt85 -121.93 -64.15 1.24 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.533 -0.758 . . . . 72.340000000000003 109.755 -173.02 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.546 ' HA ' ' O ' ' A' ' 25' ' ' GLU . 16.3 m 69.67 165.39 0.27 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.454 -0.793 . . . . 74.319999999999993 111.655 177.509 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ASP . . . . . 0.418 ' OD1' ' HB3' ' A' ' 24' ' ' ARG . 11.0 p-10 -111.24 -9.93 14.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.05 -0.523 . . . . 72.25 110.704 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.582 -0.723 . . . . 35.530000000000001 110.395 173.752 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 mmt . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.748 0.308 . . . . 52.439999999999998 110.201 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 106.98 56.9 0.61 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.929 -0.653 . . . . 63.329999999999998 112.299 177.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.7 m -116.82 78.54 1.22 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.037 0.446 . . . . 71.230000000000004 110.697 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.2 m -127.03 144.52 51.0 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.08 -0.509 . . . . 73.010000000000005 110.435 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -134.71 101.58 4.98 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.182 -0.673 . . . . 62.149999999999999 109.182 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.7 t60 -135.58 125.94 26.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.856 -0.611 . . . . 75.439999999999998 111.165 -172.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -150.3 132.98 15.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.157 -0.474 . . . . 70.129999999999995 109.903 173.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 t60 -132.8 108.95 9.31 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.724 -0.473 . . . . 72.420000000000002 109.724 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -152.04 98.5 2.44 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.302 -0.408 . . . . 74.439999999999998 111.107 -175.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -157.14 113.0 2.9 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.354 0.597 . . . . 55.530000000000001 110.344 173.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.7 m -134.5 137.23 43.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.6 -0.727 . . . . 75.129999999999995 109.661 178.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.3 m -139.55 167.04 22.99 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.038 -0.528 . . . . 73.209999999999994 110.122 -176.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 141.51 85.52 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.131 -1.033 . . . . 75.109999999999999 113.728 174.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 17.1 ptt180 -149.82 100.88 3.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.233 0.539 . . . . 73.439999999999998 110.692 172.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -166.05 144.93 5.92 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.019 -0.537 . . . . 73.140000000000001 110.275 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -179.58 19.11 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.536 0.523 . . . . 64.040000000000006 110.763 177.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 93.6 mt -101.64 156.29 17.58 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.08 0.4 . . . . 74.219999999999999 112.08 -171.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.41 ' O ' ' HB2' ' A' ' 19' ' ' PHE . 0.2 OUTLIER 72.36 -177.57 0.19 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.074 -0.966 . . . . 74.040000000000006 112.564 171.836 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.41 ' HB2' ' O ' ' A' ' 18' ' ' TYR . 87.8 m-85 78.88 63.0 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.204 1.002 . . . . 73.099999999999994 111.912 175.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -141.18 147.1 37.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.823 -0.626 . . . . 71.340000000000003 109.91 172.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 166.76 -138.84 5.41 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.472 -0.87 . . . . 65.150000000000006 112.758 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.7 m-70 -123.05 75.41 1.29 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.66 -0.496 . . . . 72.140000000000001 109.66 178.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 93.2 mt 63.17 162.88 0.1 Allowed 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.806 0.691 . . . . 72.230000000000004 110.509 -171.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.78 HH12 ' HB3' ' A' ' 97' ' ' ASP . 27.8 mmm180 -132.74 127.52 34.88 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.992 -0.442 . . . . 62.009999999999998 110.889 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.546 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 42.5 tt0 -70.56 120.93 16.92 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.557 -0.747 . . . . 74.340000000000003 109.05 174.464 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.46 HD12 HD22 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -79.6 -51.96 8.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.889 0.376 . . . . 74.530000000000001 110.098 -174.895 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.46 HD22 HD12 ' A' ' 26' ' ' LEU . 2.7 pt? -157.4 154.53 29.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.177 -0.465 . . . . 74.430000000000007 110.701 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.569 ' HG3' ' HB3' ' A' ' 69' ' ' ARG . 22.1 ttm180 -131.7 111.41 11.65 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.702 -0.851 . . . . 74.239999999999995 108.702 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.7 t -126.92 164.7 20.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.138 0.494 . . . . 72.340000000000003 111.523 -173.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -107.88 -6.89 16.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.655 -0.702 . . . . 74.439999999999998 109.955 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -95.45 134.47 38.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.763 -0.653 . . . . 74.129999999999995 111.332 -175.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.35 -33.26 49.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.813 -0.63 . . . . 73.400000000000006 111.587 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.1 t -59.96 -47.44 91.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 120.93 0.395 . . . . 63.049999999999997 110.69 -177.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.3 tp -62.22 -40.24 95.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.672 -0.695 . . . . 75.340000000000003 110.572 178.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.63 -43.41 98.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 63.520000000000003 111.081 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.6 m -59.5 -40.78 88.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.791 0.329 . . . . 55.420000000000002 111.016 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -71.97 -54.64 9.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.117 -0.492 . . . . 42.210000000000001 111.181 -177.528 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.403 HG13 HD21 ' A' ' 84' ' ' LEU . 86.9 t -61.26 -39.53 82.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.194 0.521 . . . . 73.450000000000003 110.315 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.82 -49.0 80.33 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.351 -0.841 . . . . 71.040000000000006 112.262 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.28 -33.02 74.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.639 0.257 . . . . 71.540000000000006 111.305 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 95.0 mt -65.68 -51.78 56.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.323 -0.399 . . . . 63.420000000000002 110.678 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.6 mt -74.39 -27.3 60.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.113 -0.494 . . . . 71.040000000000006 110.671 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -74.91 -55.63 5.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.13 -0.486 . . . . 61.520000000000003 110.631 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.66 -36.2 92.06 Favored Glycine 0 C--N 1.332 0.31 0 CA-C-N 115.698 -0.683 . . . . 70.310000000000002 112.84 -175.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.487 ' HB3' HG12 ' A' ' 47' ' ' ILE . . . -82.81 -1.69 52.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.763 0.316 . . . . 72.219999999999999 110.747 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.2 t70 60.72 26.78 16.55 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.462 0.648 . . . . 74.319999999999993 111.067 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.487 HG12 ' HB3' ' A' ' 45' ' ' ALA . 47.2 mm -63.64 -39.32 84.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.532 0.682 . . . . 52.219999999999999 110.106 -179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 110.64 125.79 4.9 Favored Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.208 -0.905 . . . . 61.539999999999999 112.276 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -139.0 141.81 38.32 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.71 0.291 . . . . 73.010000000000005 110.683 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.6 90.67 3.37 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.313 -0.995 . . . . 74.319999999999993 108.313 171.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.9 m -130.85 -174.63 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.974 -0.557 . . . . 72.409999999999997 111.499 -175.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 36.0 tp -160.49 156.62 26.21 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.398 -0.964 . . . . 74.530000000000001 108.398 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -70.14 145.39 51.56 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.429 -0.582 . . . . 65.420000000000002 109.429 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.448 ' O ' ' HB ' ' A' ' 66' ' ' ILE . 4.3 pp0? -122.27 18.07 10.67 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.915 0.709 . . . . 74.420000000000002 112.915 -168.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -146.72 138.39 24.49 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.268 -0.573 . . . . 60.210000000000001 110.647 177.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.447 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 3.5 mpp? -79.4 143.65 34.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.286 -0.416 . . . . 72.25 110.443 -178.487 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.6 m -83.96 63.94 7.86 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.726 -0.472 . . . . 63.240000000000002 109.726 177.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.3 mm 69.23 90.61 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 CA-C-N 115.298 -0.865 . . . . 72.019999999999996 110.373 -174.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.574 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 64.6 tp -160.37 104.75 1.45 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.605 -0.725 . . . . 70.409999999999997 109.681 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 11.7 pt-20 55.57 -54.6 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.736 1.614 . . . . 64.140000000000001 113.326 -175.323 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -106.79 114.08 4.26 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.979 -0.849 . . . . 42.100000000000001 110.979 175.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.2 m -63.24 -44.69 94.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.993 0.425 . . . . 53.109999999999999 110.845 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 44.0 tp -123.73 88.27 2.88 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.216 -0.447 . . . . 74.540000000000006 109.847 175.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.65 147.83 18.97 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 121.003 -0.618 . . . . 64.209999999999994 111.995 -179.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.1 t -106.85 91.77 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.107 0.479 . . . . 73.319999999999993 110.253 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.448 ' HB ' ' O ' ' A' ' 54' ' ' GLN . 50.1 mm -101.22 108.74 56.25 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.972 -0.558 . . . . 75.329999999999998 109.708 175.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.25 111.6 2.31 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 122.633 2.222 . . . . 61.229999999999997 111.708 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.486 ' HA ' ' HD2' ' A' ' 68' ' ' ARG . 10.1 tpt180 -100.87 140.81 34.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.38 0.61 . . . . 72.310000000000002 110.985 -177.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.569 ' HB3' ' HG3' ' A' ' 28' ' ' ARG . 28.3 ptt180 -113.61 146.69 39.35 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.135 -0.939 . . . . 74.109999999999999 110.357 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 64.6 t -110.04 116.75 53.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.415 -0.357 . . . . 61.409999999999997 110.444 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.7 mp -102.79 137.62 40.76 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.548 -0.538 . . . . 65.209999999999994 109.548 174.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 25.3 m -114.99 176.9 2.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.227 -0.442 . . . . 65.340000000000003 110.504 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -69.9 129.33 39.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.686 -0.688 . . . . 75.319999999999993 109.519 176.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.401 ' H ' ' HG2' ' A' ' 74' ' ' GLU . 5.9 pt-20 -57.75 -35.93 71.39 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.006 0.431 . . . . 64.049999999999997 111.125 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.6 -16.91 61.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.731 -0.668 . . . . 63.409999999999997 110.142 -176.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -111.33 23.62 13.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.964 -0.562 . . . . 71.540000000000006 110.093 -175.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.529 HD21 ' HB2' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -51.32 -50.86 58.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.753 -0.658 . . . . 71.099999999999994 110.711 -178.436 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.13 -28.37 66.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.019 -0.537 . . . . 64.319999999999993 111.622 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.42 -57.23 5.18 Favored Glycine 0 C--O 1.236 0.23 0 C-N-CA 120.718 -0.754 . . . . 71.409999999999997 112.611 -175.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.38 -42.87 96.75 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.889 0.329 . . . . 73.120000000000005 111.889 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 14.6 ptm180 -67.22 -33.23 74.91 Favored 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 120.943 -0.303 . . . . 72.329999999999998 110.91 -178.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -63.0 -42.28 99.81 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.016 0.436 . . . . 73.530000000000001 109.852 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 34.8 tp -58.49 -46.99 85.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.6 -0.727 . . . . 70.239999999999995 110.451 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.403 HD21 HG13 ' A' ' 38' ' ' VAL . 84.0 mt -68.49 -32.46 72.47 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.768 -0.651 . . . . 64.310000000000002 111.226 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.6 m -70.37 -36.82 74.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.975 0.417 . . . . 61.039999999999999 110.551 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -69.04 -40.58 78.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.019 -0.537 . . . . 64.019999999999996 110.445 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.48 -30.16 69.78 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.868 -0.605 . . . . 73.200000000000003 111.044 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 100.29 -13.79 59.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.121 -0.562 . . . . 73.319999999999993 112.673 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 61.6 mt -78.91 1.9 21.99 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.178 0.436 . . . . 63.530000000000001 112.178 -176.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -75.73 91.32 2.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.056 0.455 . . . . 62.119999999999997 109.827 175.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -140.46 -40.32 0.42 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.904 -0.589 . . . . 75.129999999999995 110.001 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.6 mp0 -87.39 29.63 0.85 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.627 -0.715 . . . . 71.340000000000003 111.492 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.552 HD12 ' H ' ' A' ' 93' ' ' LEU . 4.1 mp -62.81 145.1 55.76 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.705 0.288 . . . . 70.140000000000001 110.482 -178.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.431 ' HD2' ' HA ' ' A' ' 94' ' ' ARG . 2.3 tpt180 -129.43 173.19 10.78 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.728 -0.471 . . . . 71.450000000000003 109.728 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 58.2 m -149.01 121.43 8.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.861 0.362 . . . . 62.100000000000001 110.198 177.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -103.16 90.2 3.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.178 0.513 . . . . 74.450000000000003 111.316 -176.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.78 ' HB3' HH12 ' A' ' 24' ' ' ARG . 5.9 p-10 . . . . . 0 C--O 1.248 0.991 0 CA-C-N 115.537 -0.756 . . . . 75.430000000000007 109.962 177.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.484 1.255 0 CA-C-O 120.529 0.204 . . . . 72.25 110.986 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.18 127.59 0.92 Allowed Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 120.222 -0.99 . . . . 54.119999999999997 113.065 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.2 p -153.4 82.24 1.18 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.224 -0.658 . . . . 63.409999999999997 109.224 173.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.3 p -89.51 117.76 28.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.78 -0.645 . . . . 74.140000000000001 111.471 -172.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -139.37 111.44 7.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.087 -0.708 . . . . 73.430000000000007 109.087 176.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.6 p-80 -153.38 107.26 3.04 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.081 0.467 . . . . 70.140000000000001 111.18 -177.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -150.7 102.34 3.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.893 -0.594 . . . . 73.030000000000001 111.138 175.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -140.79 118.86 11.92 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.351 -0.611 . . . . 74.209999999999994 109.351 171.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -146.13 95.22 2.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.224 -0.444 . . . . 72.400000000000006 110.639 -177.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -131.76 53.23 2.01 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.814 -0.81 . . . . 64.010000000000005 108.814 174.145 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -72.46 90.87 1.34 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.324 -0.853 . . . . 72.200000000000003 110.813 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.3 p -121.4 -178.13 3.71 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.84 -0.618 . . . . 75.209999999999994 110.32 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 106.76 90.17 2.14 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.779 -0.724 . . . . 64.019999999999996 111.691 -179.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 14' ' ' ARG . 10.4 ttp180 -76.64 -65.17 0.97 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.641 -0.503 . . . . 62.329999999999998 109.641 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -172.11 111.27 0.27 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.302 -0.863 . . . . 55.240000000000002 110.093 -176.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -164.78 121.1 1.49 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.317 -0.994 . . . . 61.439999999999998 108.317 -178.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 93.1 mt -96.79 99.26 10.85 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.414 0.626 . . . . 65.310000000000002 111.144 -175.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.2 p90 -122.21 95.26 4.58 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.454 -0.793 . . . . 73.409999999999997 110.377 175.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.408 ' HB2' ' H ' ' A' ' 20' ' ' GLN . 57.3 m-85 -90.73 -88.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.158 -0.682 . . . . 72.450000000000003 109.158 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.408 ' H ' ' HB2' ' A' ' 19' ' ' PHE . 65.1 mt-30 66.21 -66.7 0.16 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 124.011 0.819 . . . . 71.010000000000005 112.552 172.243 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 152.64 153.19 6.21 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.801 -0.92 . . . . 42.109999999999999 110.801 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -108.65 -31.72 7.64 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.557 -0.534 . . . . 73.420000000000002 109.557 178.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.767 HD22 ' HB2' ' A' ' 50' ' ' LEU . 7.4 mp 66.86 154.63 0.09 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.23 -0.895 . . . . 64.530000000000001 111.518 178.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.634 ' HB2' HD11 ' A' ' 77' ' ' LEU . 13.1 mmt180 -115.2 133.18 56.27 Favored 'General case' 0 C--N 1.321 -0.668 0 O-C-N 121.831 -0.543 . . . . 65.530000000000001 110.545 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.589 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.5 tt0 -66.93 126.96 30.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.22 -0.9 . . . . 75.329999999999998 110.409 -176.247 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.477 ' CD1' ' HG2' ' A' ' 81' ' ' ARG . 20.2 tp -106.61 -58.21 1.96 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.41 -0.814 . . . . 72.040000000000006 110.772 -175.484 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.842 ' HB3' HD23 ' A' ' 93' ' ' LEU . 4.6 pp -147.71 167.99 23.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.388 -0.369 . . . . 63.549999999999997 110.1 178.508 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.538 ' HD2' ' O ' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -148.02 143.91 27.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.88 0.372 . . . . 75.129999999999995 111.527 179.213 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.8 t -174.02 163.17 3.96 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.605 -0.725 . . . . 62.310000000000002 109.995 178.002 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -100.06 -4.23 30.3 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.958 0.409 . . . . 54.25 109.924 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.8 117.68 17.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.766 -0.652 . . . . 75.439999999999998 110.344 -177.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.514 ' HB2' HH22 ' A' ' 68' ' ' ARG . . . -74.57 -38.44 62.68 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.323 -0.399 . . . . 64.109999999999999 111.263 -176.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.2 t -63.44 -46.44 95.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.088 0.471 . . . . 63.530000000000001 110.459 -177.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 tp -61.39 -39.95 92.56 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.696 -0.684 . . . . 70.450000000000003 110.584 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.556 ' HA ' HG12 ' A' ' 38' ' ' VAL . 80.9 mt -72.11 -24.65 61.52 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.957 -0.565 . . . . 75.239999999999995 111.514 -178.24 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -75.05 -27.59 60.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.945 0.403 . . . . 53.32 110.306 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.62 -53.74 7.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 71.409999999999997 110.582 177.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.73 HG21 HD21 ' A' ' 27' ' ' LEU . 7.2 p -64.92 -35.37 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 120.915 0.388 . . . . 65.439999999999998 111.153 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.37 -38.97 95.53 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.004 -0.617 . . . . 64.439999999999998 112.307 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.96 -29.98 70.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.878 0.371 . . . . 65.200000000000003 111.135 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 88.0 mt -69.39 -49.18 57.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.127 -0.488 . . . . 63.210000000000001 109.968 178.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.9 mt -66.15 -35.0 79.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.672 -0.695 . . . . 74.109999999999999 110.589 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.12 -52.43 48.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.769 -0.651 . . . . 73.109999999999999 110.737 176.196 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.53 -26.88 73.57 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.689 -0.687 . . . . 71.230000000000004 113.966 -173.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.02 9.11 37.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.835 0.318 . . . . 74.430000000000007 111.826 -177.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.6 t70 61.17 29.13 18.63 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.753 0.787 . . . . 73.510000000000005 110.732 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.3 mt -84.26 -47.62 17.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.541 0.686 . . . . 65.209999999999994 110.185 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.21 172.74 38.67 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.083 -0.962 . . . . 73.439999999999998 111.601 -176.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -169.24 142.13 2.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.946 0.403 . . . . 73.239999999999995 111.406 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.767 ' HB2' HD22 ' A' ' 23' ' ' LEU . 1.9 tm? -97.19 102.25 13.98 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.355 -0.98 . . . . 74.230000000000004 108.355 172.159 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.7 m -131.48 161.66 40.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.977 -0.556 . . . . 64.129999999999995 110.468 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 95.9 mt 68.88 170.69 0.29 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.738 -0.665 . . . . 74.230000000000004 111.516 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -170.59 -45.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.785 -0.643 . . . . 74.230000000000004 110.521 -177.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -57.74 -54.98 40.73 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.321 -0.399 . . . . 71.299999999999997 111.375 -178.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 57.9 t30 72.02 -40.72 0.48 Allowed 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.877 0.736 . . . . 74.519999999999996 111.91 177.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 78.9 mtp -73.73 168.63 18.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.833 0.349 . . . . 75.030000000000001 110.746 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.2 p -75.32 164.18 26.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.034 -0.53 . . . . 64.439999999999998 110.224 176.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 5.8 tp -73.5 103.89 2.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.507 0.67 . . . . 74.530000000000001 110.426 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -107.01 127.27 53.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.344 -0.843 . . . . 71.510000000000005 109.059 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -60.83 124.2 19.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.445 0.641 . . . . 73.239999999999995 110.767 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 128.15 -32.55 3.39 Favored Glycine 0 N--CA 1.443 -0.868 0 N-CA-C 110.497 -1.041 . . . . 71.019999999999996 110.497 -173.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.3 p -105.04 104.37 14.1 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.173 -0.677 . . . . 75.230000000000004 109.173 171.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.8 mp -86.1 85.11 7.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.432 0.635 . . . . 75.099999999999994 109.975 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -124.61 109.75 1.29 Allowed Glycine 0 N--CA 1.439 -1.116 0 C-N-CA 120.694 -0.765 . . . . 72.129999999999995 112.728 -177.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 38.8 t -86.25 -16.08 9.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.42 -0.956 . . . . 53.340000000000003 108.42 169.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.73 HG22 ' HG3' ' A' ' 68' ' ' ARG . 5.0 mp 57.41 85.53 0.19 Allowed Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 114.029 -1.441 . . . . 73.540000000000006 111.131 -178.067 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.01 90.9 0.44 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.302 2.002 . . . . 73.340000000000003 110.237 172.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.73 ' HG3' HG22 ' A' ' 66' ' ' ILE . 64.5 mtm180 -75.83 126.46 31.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.671 0.748 . . . . 73.140000000000001 112.337 -170.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -113.13 131.43 55.84 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.584 -1.189 . . . . 72.329999999999998 108.023 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 55.5 t -101.45 111.6 31.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-O 120.769 0.319 . . . . 75.439999999999998 110.772 -172.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.658 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 7.7 mp -102.73 142.73 33.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.639 -0.71 . . . . 74.0 109.104 174.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 20.6 m -119.96 174.26 5.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.204 0.526 . . . . 73.329999999999998 111.484 -174.057 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -57.69 121.89 11.48 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.812 -1.086 . . . . 64.049999999999997 110.949 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.565 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 36.9 mt-10 -62.87 154.0 31.47 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.879 -0.6 . . . . 71.219999999999999 109.459 177.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.565 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 8.6 t70 78.92 -16.79 0.64 Allowed 'General case' 0 N--CA 1.473 0.689 0 O-C-N 123.921 0.763 . . . . 71.349999999999994 111.213 -173.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.36 16.87 25.25 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.159 0.504 . . . . 73.219999999999999 110.246 -177.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.634 HD11 ' HB2' ' A' ' 24' ' ' ARG . 4.2 mm? -60.94 -49.09 78.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.671 -0.695 . . . . 61.340000000000003 111.295 -177.106 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.42 -22.46 66.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.912 0.387 . . . . 44.409999999999997 111.192 -178.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -84.61 -56.08 2.57 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.642 -0.79 . . . . 64.340000000000003 112.541 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.412 ' O ' HD13 ' A' ' 84' ' ' LEU . . . -61.17 -44.42 97.34 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.749 0.277 . . . . 65.150000000000006 111.749 -176.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.477 ' HG2' ' CD1' ' A' ' 26' ' ' LEU . 18.3 mtp180 -63.13 -36.96 85.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.937 0.399 . . . . 62.130000000000003 110.243 -178.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -68.34 -44.07 76.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.993 -0.548 . . . . 73.420000000000002 110.582 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.5 tp -56.28 -49.87 73.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 74.25 111.019 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.412 HD13 ' O ' ' A' ' 80' ' ' ALA . 9.1 mp -67.67 -28.23 67.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 75.340000000000003 111.416 -178.395 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.59 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.3 m -81.08 -40.02 24.79 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.47 -0.332 . . . . 74.519999999999996 111.211 -178.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -74.22 -42.28 60.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.27 -0.423 . . . . 63.420000000000002 111.217 -177.035 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.8 83.82 1.09 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.12 0.486 . . . . 62.109999999999999 110.361 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -170.33 -96.1 0.1 Allowed Glycine 0 N--CA 1.441 -1.01 0 C-N-CA 120.323 -0.942 . . . . 44.299999999999997 112.429 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.623 HD11 ' HB ' ' A' ' 38' ' ' VAL . 1.2 pp -175.0 48.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.197 0.522 . . . . 71.150000000000006 111.182 -172.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.59 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . -68.44 93.79 0.51 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.173 -0.467 . . . . 54.409999999999997 111.587 -177.034 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -151.14 -47.91 0.12 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.061 -0.518 . . . . 74.530000000000001 110.187 176.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -76.73 -0.3 23.19 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.64 -0.709 . . . . 75.340000000000003 110.869 -178.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.842 HD23 ' HB3' ' A' ' 27' ' ' LEU . 90.5 mt -66.91 140.47 57.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.004 -0.544 . . . . 73.299999999999997 110.671 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' A' ' 95' ' ' SER . 45.3 ttt180 -104.54 139.91 38.74 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.85 -0.34 . . . . 74.310000000000002 110.193 175.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.497 ' O ' ' HG2' ' A' ' 94' ' ' ARG . 30.2 m -72.02 162.56 29.29 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.623 -0.51 . . . . 62.310000000000002 109.623 173.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -80.16 52.65 1.59 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.18 0.515 . . . . 63.140000000000001 110.584 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 27.8 t70 . . . . . 0 C--O 1.243 0.737 0 CA-C-N 115.734 -0.666 . . . . 53.310000000000002 109.618 -178.371 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 109.775 -0.454 . . . . 54.210000000000001 109.775 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 174.82 -62.2 0.11 Allowed Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.591 -0.814 . . . . 55.439999999999998 112.216 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.4 m -105.38 101.13 10.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.863 0.363 . . . . 61.329999999999998 110.538 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.2 p -121.69 107.63 12.58 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.041 -0.527 . . . . 64.340000000000003 110.4 177.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -113.58 127.07 55.93 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.548 0.689 . . . . 73.219999999999999 111.505 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -157.04 93.75 1.36 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.889 -1.051 . . . . 72.230000000000004 108.699 175.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -148.8 154.68 39.88 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.367 -0.833 . . . . 60.409999999999997 110.33 -173.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.1 p-80 -156.39 143.12 18.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.826 0.346 . . . . 64.409999999999997 110.739 -177.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -139.82 91.19 2.45 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.944 -0.571 . . . . 71.400000000000006 109.487 177.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -142.0 109.05 5.47 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.047 0.451 . . . . 74.030000000000001 110.563 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.7 t -82.13 -175.78 5.82 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.697 -0.683 . . . . 70.319999999999993 109.376 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.8 m -81.15 78.54 7.94 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.055 0.455 . . . . 74.219999999999999 110.391 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -118.46 134.13 10.74 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.881 -0.675 . . . . 71.219999999999999 111.802 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 14' ' ' ARG . 30.6 ttt180 -164.41 125.54 2.17 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.829 0.347 . . . . 73.420000000000002 110.287 -179.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -142.48 73.59 1.41 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.411 -0.589 . . . . 63.539999999999999 109.411 176.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.562 ' HB3' ' HA ' ' A' ' 75' ' ' ASP . 8.9 p30 -154.42 104.66 2.59 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.858 0.837 . . . . 73.099999999999994 110.717 176.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 90.8 mt -94.32 -5.43 46.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.396 -0.82 . . . . 65.420000000000002 109.171 171.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -116.38 108.53 16.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.906 -1.043 . . . . 70.540000000000006 109.818 178.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -90.21 128.66 36.43 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.048 -0.524 . . . . 72.200000000000003 109.873 177.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.534 ' HG2' ' HG2' ' A' ' 24' ' ' ARG . 21.0 tp60 -96.55 -48.61 5.47 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.51 -0.552 . . . . 74.099999999999994 109.51 -179.091 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 148.34 -59.59 0.46 Allowed Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 115.451 -0.795 . . . . 42.219999999999999 111.896 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -145.2 -55.1 0.31 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.8 0.333 . . . . 62.229999999999997 111.379 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . 72.8 mt -133.62 153.33 51.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.336 -0.393 . . . . 74.420000000000002 110.674 -175.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.783 HH11 ' HG ' ' A' ' 77' ' ' LEU . 43.1 mtp180 -126.31 135.36 51.41 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.895 -0.409 . . . . 70.0 109.895 174.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.532 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.7 tt0 -68.77 110.47 4.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.04 -0.527 . . . . 74.209999999999994 109.711 177.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.5 tp -88.82 -52.18 5.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 111.131 -174.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.463 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 2.4 pt? -151.41 149.12 28.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.568 -0.287 . . . . 74.540000000000006 110.46 179.2 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -139.59 137.34 35.28 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.979 -0.378 . . . . 74.120000000000005 109.979 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.1 t -156.39 -175.7 5.57 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.143 -0.481 . . . . 73.530000000000001 109.973 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -106.78 -3.19 20.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.012 0.434 . . . . 71.109999999999999 110.614 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -107.28 134.75 49.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.959 -0.564 . . . . 74.310000000000002 111.252 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -93.76 -17.31 23.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.096 -0.502 . . . . 41.509999999999998 110.941 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t -65.24 -53.24 42.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-O 120.926 0.393 . . . . 74.019999999999996 110.451 -178.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.91 -34.48 78.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.189 -0.459 . . . . 74.010000000000005 110.732 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 66.7 mt -66.94 -32.03 73.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.447 -0.342 . . . . 51.399999999999999 111.032 179.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.9 m -67.52 -28.5 67.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.063 0.459 . . . . 74.150000000000006 110.333 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.87 -42.16 61.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.095 -0.502 . . . . 75.129999999999995 109.926 174.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.609 HG13 HD21 ' A' ' 84' ' ' LEU . 92.6 t -63.17 -45.35 98.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.646 -0.706 . . . . 61.100000000000001 110.721 176.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.47 -40.57 96.36 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.811 -0.632 . . . . 34.420000000000002 112.478 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.44 -33.43 74.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 72.439999999999998 111.184 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 87.2 mt -69.51 -51.28 37.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.147 0.498 . . . . 64.040000000000006 110.223 178.481 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.95 -47.19 81.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.699 -0.682 . . . . 70.25 110.815 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -66.65 -29.22 69.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 72.340000000000003 110.246 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.55 -28.56 73.11 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 121.094 -0.574 . . . . 65.430000000000007 112.32 178.137 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -96.45 11.8 33.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.852 0.358 . . . . 74.409999999999997 110.504 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.9 t70 66.86 19.64 10.64 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.561 -0.745 . . . . 74.049999999999997 110.89 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.9 mt -84.46 113.35 23.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.267 -0.424 . . . . 74.219999999999999 109.985 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.26 120.74 23.9 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 115.915 -0.584 . . . . 63.030000000000001 112.431 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -109.27 136.33 48.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.78 0.324 . . . . 75.439999999999998 110.841 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -94.38 94.77 8.46 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.007 -0.738 . . . . 62.229999999999997 109.007 176.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.419 HG22 HG22 ' A' ' 70' ' ' VAL . 20.7 t -127.78 104.86 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.728 -0.669 . . . . 62.32 110.17 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 52' ' ' LEU . 2.1 tm? -104.67 115.03 29.63 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.365 -0.606 . . . . 73.030000000000001 109.365 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -88.2 127.96 35.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.24 0.543 . . . . 62.219999999999999 109.976 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -112.24 94.11 4.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.961 -0.563 . . . . 54.009999999999998 109.743 -178.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 56.7 m-80 -124.25 119.41 29.26 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.845 -0.616 . . . . 74.219999999999999 110.995 -176.312 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 21.8 ttt -93.49 -63.12 1.24 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.964 -0.754 . . . . 75.420000000000002 108.964 174.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.7 m -161.32 143.68 12.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.323 -0.853 . . . . 71.430000000000007 108.899 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.6 tt -75.55 84.98 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.97 0.89 . . . . 63.329999999999998 110.436 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.5 tp -112.01 104.67 12.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.126 -0.943 . . . . 52.140000000000001 110.039 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 56.05 78.91 0.18 Allowed 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.801 0.688 . . . . 61.100000000000001 111.264 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.55 35.3 3.64 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.95 -0.643 . . . . 55.25 112.624 -176.281 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.1 m -107.69 23.17 14.88 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.471 0.653 . . . . 64.430000000000007 109.601 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.9 tp -133.9 143.74 48.44 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.178 -0.919 . . . . 74.219999999999999 109.401 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.85 78.27 0.64 Allowed Glycine 0 C--N 1.33 0.25 0 C-N-CA 121.029 -0.605 . . . . 32.409999999999997 112.533 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.654 HG12 HG12 ' A' ' 66' ' ' ILE . 23.0 t -103.69 146.28 11.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 110.255 -0.276 . . . . 72.420000000000002 110.255 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.654 HG12 HG12 ' A' ' 65' ' ' VAL . 46.1 mm 70.0 97.41 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.398 0 O-C-N 123.737 0.648 . . . . 71.310000000000002 111.602 177.153 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -75.63 97.03 1.07 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.823 2.349 . . . . 75.519999999999996 111.262 176.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.604 ' HA ' ' NE ' ' A' ' 68' ' ' ARG . 2.6 mmp_? -92.9 136.22 33.45 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.228 -0.442 . . . . 74.040000000000006 111.234 -176.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.1 ptt180 -145.02 144.99 31.31 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.753 -0.658 . . . . 70.340000000000003 111.0 -178.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.419 HG22 HG22 ' A' ' 51' ' ' VAL . 53.7 t -105.71 127.42 60.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.906 -0.588 . . . . 73.329999999999998 110.245 179.771 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.532 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 7.6 mp -113.27 137.78 50.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.153 -0.476 . . . . 70.230000000000004 110.337 178.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.7 m -104.8 160.78 5.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.051 -0.522 . . . . 63.340000000000003 110.572 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.426 ' HA ' HD23 ' A' ' 23' ' ' LEU . 78.7 m80 -84.47 40.81 0.8 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.512 -0.313 . . . . 75.319999999999993 111.585 -176.429 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 67.69 -173.2 0.19 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.806 -0.634 . . . . 63.509999999999998 112.401 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.562 ' HA ' ' HB3' ' A' ' 16' ' ' ASN . 27.2 t70 68.57 -70.76 0.13 Allowed 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 114.678 -1.146 . . . . 61.149999999999999 112.538 177.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.18 40.22 0.54 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.832 0.349 . . . . 71.219999999999999 111.746 -175.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.783 ' HG ' HH11 ' A' ' 24' ' ' ARG . 3.7 mm? -64.29 -49.98 69.69 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.737 -0.468 . . . . 63.32 109.737 175.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.72 -33.46 70.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.852 -0.613 . . . . 55.409999999999997 110.304 178.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.46 -52.48 48.81 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.891 -0.671 . . . . 71.239999999999995 112.138 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.42 86.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.472 0.177 . . . . 60.329999999999998 111.17 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -57.4 -48.82 78.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.487 -0.324 . . . . 64.010000000000005 111.352 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -67.51 -37.29 82.59 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 121.024 -0.27 . . . . 74.340000000000003 110.77 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 60.0 tp -60.62 -51.35 69.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.039 0.447 . . . . 73.109999999999999 110.52 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.609 HD21 HG13 ' A' ' 38' ' ' VAL . 10.5 mp -64.6 -33.79 76.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.907 -0.588 . . . . 72.129999999999995 111.326 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.824 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 95.3 m -66.92 -44.04 81.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.345 -0.389 . . . . 73.430000000000007 110.639 178.168 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -68.04 -35.29 78.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 71.219999999999999 110.136 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.57 -44.77 93.19 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.765 -0.652 . . . . 72.540000000000006 111.16 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 127.21 -14.78 6.52 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.228 -0.987 . . . . 70.030000000000001 113.602 175.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.511 HD11 ' HG ' ' A' ' 84' ' ' LEU . 1.6 pp -94.79 19.32 10.27 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.321 0.489 . . . . 64.310000000000002 112.321 -175.362 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.834 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -68.63 84.54 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.94 0.4 . . . . 74.319999999999993 110.51 176.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -145.77 -48.05 0.22 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.839 -0.618 . . . . 72.040000000000006 109.883 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -79.87 -7.63 58.83 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.021 0.439 . . . . 62.32 110.543 -179.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.834 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.1 mp -67.09 134.83 52.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.891 -0.595 . . . . 73.030000000000001 110.094 178.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -131.99 112.59 12.52 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.094 0.473 . . . . 54.240000000000002 110.869 -177.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 49.1 m -118.47 107.37 13.72 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.731 -0.47 . . . . 63.539999999999999 109.731 175.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -76.52 132.97 39.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.273 -0.421 . . . . 73.150000000000006 110.493 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.6 t70 . . . . . 0 C--O 1.247 0.969 0 O-C-N 124.192 0.932 . . . . 74.150000000000006 109.851 -177.397 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 120.769 0.319 . . . . 62.32 110.337 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 95.25 89.69 1.74 Allowed Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.915 -0.659 . . . . 64.209999999999994 111.594 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.3 m -70.36 104.7 2.78 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.026 0.441 . . . . 73.340000000000003 110.733 -178.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 p -120.15 129.53 54.18 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 116.002 -0.544 . . . . 44.229999999999997 111.174 -177.394 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -147.48 20.62 1.19 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.635 -0.712 . . . . 72.329999999999998 109.677 174.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.9 m80 -109.53 116.94 32.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.042 -0.981 . . . . 72.310000000000002 110.744 179.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -132.66 116.76 17.05 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.844 -0.798 . . . . 72.010000000000005 108.844 170.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -142.86 126.44 16.87 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.871 -0.604 . . . . 72.400000000000006 111.091 -169.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -176.91 154.76 1.15 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.956 -0.565 . . . . 74.409999999999997 110.217 174.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -153.31 89.12 1.33 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.19 0.519 . . . . 62.340000000000003 109.682 175.318 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.3 p -75.07 143.27 43.53 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.771 -0.649 . . . . 72.140000000000001 111.091 -175.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.4 m -144.78 96.33 2.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 74.099999999999994 110.231 178.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -177.72 127.52 1.19 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 121.011 -0.614 . . . . 62.409999999999997 111.675 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -151.22 -31.12 0.17 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.915 0.388 . . . . 75.540000000000006 110.642 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -83.33 125.28 31.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.335 -0.393 . . . . 70.400000000000006 110.042 178.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.9 p-10 -148.9 65.25 1.04 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.477 0.656 . . . . 71.310000000000002 110.737 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.5 mp -99.34 116.23 31.04 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.842 -0.617 . . . . 71.219999999999999 110.21 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -77.28 80.91 3.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.275 0.559 . . . . 74.549999999999997 110.909 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -134.63 83.76 2.06 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.589 -0.732 . . . . 72.530000000000001 110.238 177.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -93.62 -17.76 22.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.373 0.606 . . . . 74.510000000000005 110.098 177.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.432 ' O ' ' HB3' ' A' ' 22' ' ' HIS . . . -104.19 -172.32 25.15 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.897 -0.881 . . . . 61.020000000000003 110.897 177.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.432 ' HB3' ' O ' ' A' ' 21' ' ' GLY . 44.6 t60 73.25 121.03 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.113 0.483 . . . . 64.420000000000002 110.545 178.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.1 mp -112.7 146.41 38.76 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.301 -0.408 . . . . 71.519999999999996 110.524 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.401 ' O ' ' HA ' ' A' ' 71' ' ' LEU . 66.9 mtt180 -113.66 144.42 42.94 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.705 -0.48 . . . . 72.140000000000001 109.705 175.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.531 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 80.3 tt0 -77.11 110.59 11.91 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.783 -1.191 . . . . 72.239999999999995 107.783 172.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.557 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -79.92 -52.62 7.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.941 -0.572 . . . . 62.539999999999999 110.075 -173.011 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.655 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 2.1 pt? -152.52 150.72 29.88 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.735 -0.666 . . . . 71.409999999999997 109.491 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.481 ' HD2' ' OE2' ' A' ' 25' ' ' GLU . 8.7 ptm85 -132.53 121.56 23.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.282 0.563 . . . . 72.230000000000004 110.206 176.106 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.8 t -119.25 168.87 10.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.507 -0.77 . . . . 73.129999999999995 110.625 -175.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -117.05 7.96 13.24 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.54 -0.541 . . . . 73.430000000000007 109.54 174.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -105.38 142.43 35.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.4 -0.818 . . . . 72.430000000000007 110.134 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.443 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -94.94 -24.4 16.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.453 -0.339 . . . . 74.340000000000003 111.63 -175.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.5 t -77.99 -36.37 21.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.142 0.496 . . . . 71.340000000000003 110.137 -176.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.6 tp -61.16 -34.61 75.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.589 -0.732 . . . . 75.310000000000002 110.304 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.74 HD11 ' HG3' ' A' ' 68' ' ' ARG . 87.7 mt -63.26 -35.45 80.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.88 -0.6 . . . . 64.230000000000004 110.885 178.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.0 m -68.29 -27.66 66.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.218 0.532 . . . . 62.32 110.632 178.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.18 -51.11 8.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.852 -0.613 . . . . 54.100000000000001 110.804 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.487 HG12 ' HA ' ' A' ' 35' ' ' LEU . 9.8 p -65.8 -34.26 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.25 -0.432 . . . . 52.119999999999997 110.514 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.21 -48.03 83.0 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 121.08 -0.581 . . . . 63.119999999999997 112.557 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.72 -25.26 67.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.107 0.48 . . . . 72.040000000000006 111.243 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.557 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.4 mt -75.6 -52.37 10.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.055 -0.52 . . . . 73.049999999999997 110.075 177.695 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.27 -49.15 75.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.748 -0.66 . . . . 74.310000000000002 111.104 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -63.6 -28.17 69.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.396 -0.365 . . . . 65.25 110.803 -178.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -73.44 -18.56 79.41 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.799 -0.715 . . . . 45.340000000000003 112.573 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -114.41 15.43 17.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.707 0.262 . . . . 63.43 111.707 -176.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.9 t70 71.45 7.35 6.01 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.426 0.631 . . . . 73.129999999999995 111.544 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 58.5 mt -70.96 112.09 5.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.169 -0.469 . . . . 74.409999999999997 111.01 -176.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -64.68 130.95 37.22 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.844 -0.616 . . . . 51.219999999999999 112.015 177.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 19.6 p80 -138.41 147.35 43.25 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.708 0.289 . . . . 72.129999999999995 110.769 -177.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 71' ' ' LEU . 77.3 mt -82.8 -65.92 0.95 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.092 -0.503 . . . . 70.430000000000007 110.996 176.486 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 54.5 t 64.15 78.9 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.875 0.845 . . . . 63.32 110.602 -177.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 pp -170.92 -166.18 0.47 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.491 -1.231 . . . . 72.140000000000001 107.776 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -167.66 -82.86 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.404 -0.591 . . . . 71.140000000000001 109.404 172.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.3 tm0? -103.5 107.17 17.9 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.346 -0.983 . . . . 75.310000000000002 108.346 174.154 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -73.68 121.36 20.62 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.707 -0.479 . . . . 73.109999999999999 109.707 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.6 ' HB3' ' HA3' ' A' ' 61' ' ' GLY . 23.4 ptt? -51.29 113.28 0.9 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.458 0.647 . . . . 71.340000000000003 110.191 178.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.72 ' HB2' HD12 ' A' ' 58' ' ' ILE . 19.7 m -109.49 -61.14 1.68 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.498 -0.774 . . . . 75.219999999999999 111.568 -171.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.72 HD12 ' HB2' ' A' ' 57' ' ' SER . 4.8 mp -94.55 -73.9 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.98 0.419 . . . . 63.32 111.415 -171.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 68.1 tp -121.84 -53.51 1.96 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.424 -0.353 . . . . 72.150000000000006 111.797 -171.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.78 160.07 16.26 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.34 0.591 . . . . 71.519999999999996 111.464 -172.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.6 ' HA3' ' HB3' ' A' ' 56' ' ' MET . . . 161.37 14.56 0.03 OUTLIER Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 114.773 -1.103 . . . . 74.019999999999996 111.441 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 61' ' ' GLY . 32.6 p -139.93 -39.94 0.45 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.935 0.346 . . . . 75.25 111.935 -177.005 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -72.89 -42.51 63.52 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.731 0.3 . . . . 71.140000000000001 111.227 -176.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.45 -178.81 46.18 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.038 -0.601 . . . . 50.140000000000001 112.559 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.0 t -97.01 93.38 3.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.179 0.514 . . . . 75.219999999999999 109.979 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.3 mp -92.31 119.49 68.1 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.777 -0.647 . . . . 61.409999999999997 109.773 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -63.64 167.31 13.69 Favored 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.901 2.401 . . . . 73.450000000000003 111.89 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.74 ' HG3' HD11 ' A' ' 35' ' ' LEU . 13.3 mmt85 -130.02 122.52 28.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.186 -0.301 . . . . 72.400000000000006 110.186 -177.705 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.721 ' HD3' HD11 ' A' ' 71' ' ' LEU . 1.8 ptp180 -112.66 136.44 52.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.196 0.522 . . . . 74.299999999999997 110.402 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 48.2 t -106.97 111.64 36.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.991 -0.55 . . . . 52.340000000000003 110.162 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.721 HD11 ' HD3' ' A' ' 69' ' ' ARG . 7.6 mp -104.62 139.78 38.97 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.34 -0.391 . . . . 75.409999999999997 110.253 177.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.8 m -130.27 168.68 22.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 O-C-N 123.73 0.644 . . . . 74.450000000000003 110.038 177.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 -82.38 163.22 21.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.292 -0.413 . . . . 63.340000000000003 110.83 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -59.45 -27.07 65.74 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.293 -0.412 . . . . 62.530000000000001 110.169 174.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -43.41 -59.12 2.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.218 -0.901 . . . . 74.5 111.781 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -116.79 35.42 4.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.181 -0.463 . . . . 74.340000000000003 110.31 -175.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.496 ' O ' ' HG3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -59.71 -53.89 52.69 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.363 -0.606 . . . . 73.120000000000005 109.363 178.675 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.48 -30.34 69.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.977 -0.556 . . . . 41.43 110.704 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.87 -49.32 49.36 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.802 -0.635 . . . . 62.32 112.389 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.75 -39.51 93.75 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.387 0.137 . . . . 62.399999999999999 110.71 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 77' ' ' LEU . 73.5 mtp180 -57.66 -47.92 80.94 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 110.088 -0.338 . . . . 72.430000000000007 110.088 175.407 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 82' ' ' ARG . 3.8 tpp180 -58.12 -50.9 71.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.79 -0.641 . . . . 73.219999999999999 110.494 178.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.557 HD21 ' HB3' ' A' ' 41' ' ' LEU . 55.7 tp -58.35 -52.18 66.69 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.529 -0.76 . . . . 75.209999999999994 111.856 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.98 -33.43 73.68 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.624 0.25 . . . . 73.420000000000002 111.643 -177.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.969 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 53.4 m -73.3 -36.67 66.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.1 0.476 . . . . 45.130000000000003 110.633 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -74.53 -32.79 62.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.83 -0.623 . . . . 71.430000000000007 110.3 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.57 96.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.776 -0.647 . . . . 72.5 111.807 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 150.94 -47.4 0.59 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 119.76 -1.21 . . . . 73.010000000000005 113.622 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.825 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -53.58 -75.77 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.7 0.25 . . . . 74.230000000000004 111.504 -175.014 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.969 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 42.2 38.89 1.24 Allowed 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.573 0.582 . . . . 53.229999999999997 112.573 178.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 29.5 t-80 -132.78 -46.44 0.87 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.385 0.612 . . . . 73.510000000000005 110.375 -176.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -71.09 -13.25 61.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.038 -0.983 . . . . 73.030000000000001 110.892 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.655 ' HA ' ' HB3' ' A' ' 27' ' ' LEU . 6.7 mp -66.13 96.0 0.31 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.881 -0.6 . . . . 72.450000000000003 110.131 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -178.67 135.28 0.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.043 -0.526 . . . . 63.240000000000002 110.577 -172.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 21.5 m -159.1 -47.24 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.844 0.354 . . . . 54.109999999999999 111.819 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -80.78 6.26 13.49 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.209 0.528 . . . . 73.219999999999999 111.421 -174.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.3 t70 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 117.979 -1.01 . . . . 65.329999999999998 110.217 -177.337 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttt . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.169 0.509 . . . . 71.109999999999999 110.109 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -174.97 54.71 0.13 Allowed Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 110.865 -0.894 . . . . 64.340000000000003 110.865 178.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.4 p -90.77 -4.52 56.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.49 -0.355 . . . . 73.549999999999997 111.888 -173.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.2 p -76.35 71.86 3.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.114 0.483 . . . . 74.310000000000002 112.238 -175.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -163.35 121.22 1.92 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.139 0.495 . . . . 75.299999999999997 111.49 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -118.56 -113.81 0.33 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 107.434 -1.321 . . . . 62.109999999999999 107.434 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 62.91 28.44 16.34 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.174 0.512 . . . . 63.030000000000001 111.815 166.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -114.48 105.39 13.05 Favored 'General case' 0 C--N 1.329 -0.31 0 O-C-N 121.699 -0.626 . . . . 65.349999999999994 111.558 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.4 p80 -160.81 126.63 3.9 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.917 -0.401 . . . . 60.439999999999998 109.917 170.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.4 t-160 -160.31 70.08 0.41 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.226 0.536 . . . . 70.340000000000003 109.689 178.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 p -99.38 101.36 12.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.738 -0.664 . . . . 54.329999999999998 110.607 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.6 m -152.2 86.27 1.29 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.334 -0.394 . . . . 45.210000000000001 110.558 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -132.6 37.27 2.05 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.858 -0.687 . . . . 61.240000000000002 111.938 179.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -101.97 36.0 2.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.082 0.468 . . . . 75.030000000000001 110.218 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -83.67 115.65 22.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.754 -0.657 . . . . 70.230000000000004 110.458 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -171.02 85.85 0.1 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.615 -0.721 . . . . 62.030000000000001 109.307 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -159.37 106.95 1.76 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.762 -0.829 . . . . 71.450000000000003 108.762 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -157.87 95.25 1.39 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.918 0.389 . . . . 72.430000000000007 110.869 -177.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -97.03 104.91 16.97 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.396 -0.594 . . . . 72.140000000000001 109.396 175.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -90.49 137.15 32.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.185 0.517 . . . . 72.340000000000003 110.901 -175.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.65 -139.19 4.36 Favored Glycine 0 N--CA 1.442 -0.903 0 N-CA-C 110.39 -1.084 . . . . 62.130000000000003 110.39 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -143.09 -170.12 3.18 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 117.024 0.412 . . . . 73.329999999999998 110.3 175.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.468 ' HB3' HD23 ' A' ' 71' ' ' LEU . 95.3 mt -58.03 116.94 3.83 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.212 -0.449 . . . . 51.240000000000002 111.555 -175.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 50.3 mmm-85 -106.09 132.99 51.51 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.722 -0.672 . . . . 74.040000000000006 109.87 177.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.544 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 22.3 tt0 -80.31 110.69 15.99 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.291 -0.633 . . . . 74.200000000000003 109.291 -179.359 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.671 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -84.62 -55.0 4.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.051 -0.522 . . . . 55.329999999999998 110.667 -172.597 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.782 ' HB3' HD23 ' A' ' 93' ' ' LEU . 1.2 pt? -142.59 153.99 44.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.14 -0.482 . . . . 72.329999999999998 110.689 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 28' ' ' ARG . 4.7 tmm_? -139.98 130.8 25.97 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.324 -0.853 . . . . 71.319999999999993 109.07 -178.78 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.0 t -167.11 175.5 7.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.118 -0.327 . . . . 60.439999999999998 110.118 178.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.418 ' HB3' HG11 ' A' ' 65' ' ' VAL . 77.2 m-20 -119.53 4.07 11.17 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.368 -0.378 . . . . 64.319999999999993 110.202 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -85.6 108.27 17.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 54.130000000000003 110.353 -178.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.62 -35.91 81.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.728 -0.669 . . . . 75.430000000000007 111.52 -176.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 50.7 t -62.06 -51.95 66.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.911 0.386 . . . . 65.129999999999995 110.437 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.558 HD11 HD13 ' A' ' 89' ' ' LEU . 32.9 tp -64.45 -42.13 96.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.989 -0.55 . . . . 72.219999999999999 110.853 -179.341 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.404 HD13 ' HD2' ' A' ' 68' ' ' ARG . 62.1 mt -59.35 -38.95 81.69 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.778 0.323 . . . . 60.200000000000003 111.201 178.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 m -66.43 -38.72 88.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.918 0.39 . . . . 74.200000000000003 110.496 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.58 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.29 -46.52 80.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 60.219999999999999 110.288 177.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.555 HG13 HD21 ' A' ' 84' ' ' LEU . 95.5 t -59.59 -43.54 91.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 65.420000000000002 110.751 178.441 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.22 -43.68 97.01 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.985 -0.626 . . . . 74.219999999999999 111.918 178.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.47 -36.08 82.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.721 0.296 . . . . 50.43 110.886 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 94.2 mt -65.35 -52.29 54.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.004 0.431 . . . . 63.520000000000003 110.395 178.357 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.0 mt -64.53 -36.73 85.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.808 -0.633 . . . . 75.239999999999995 110.859 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -65.1 -39.96 93.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.029 -0.532 . . . . 72.109999999999999 110.305 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.61 -21.43 74.67 Favored Glycine 0 CA--C 1.518 0.239 0 CA-C-N 115.804 -0.635 . . . . 73.349999999999994 112.876 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -101.63 0.66 36.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.957 0.408 . . . . 65.430000000000007 110.338 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 t70 59.59 30.09 19.7 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.27 -0.877 . . . . 74.219999999999999 111.253 178.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 65.2 mt -79.67 114.83 21.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-N 115.962 -0.563 . . . . 72.319999999999993 110.158 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.21 110.87 2.71 Favored Glycine 0 N--CA 1.453 -0.195 0 CA-C-N 116.06 -0.518 . . . . 60.399999999999999 112.183 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 54.2 p-80 -131.36 137.86 48.92 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.71 0.29 . . . . 73.120000000000005 110.808 -175.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 92.8 mt -112.63 146.55 38.42 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.665 -0.495 . . . . 73.540000000000006 109.665 177.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.629 HG23 ' HG ' ' A' ' 52' ' ' LEU . 16.7 m -140.25 -164.22 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.486 -0.325 . . . . 74.109999999999999 110.452 -176.49 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.629 ' HG ' HG23 ' A' ' 51' ' ' VAL . 96.5 mt 75.89 -168.78 0.08 Allowed 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.926 0.766 . . . . 61.32 111.744 175.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -177.17 -56.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 107.939 -1.134 . . . . 74.549999999999997 107.939 -179.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -134.69 137.59 43.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.388 -1.278 . . . . 75.329999999999998 108.426 170.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -119.36 153.86 34.48 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.029 0.442 . . . . 74.519999999999996 111.39 -175.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 50.6 ttp -171.43 150.02 2.79 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.5 -0.926 . . . . 61.0 108.5 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 61.8 m -62.46 126.82 28.64 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.754 -0.378 . . . . 72.25 110.077 174.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.431 ' O ' ' HB2' ' A' ' 59' ' ' LEU . 38.5 mm -82.32 -21.39 9.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 73.040000000000006 110.447 -175.542 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 58' ' ' ILE . 57.2 mt 70.28 -74.92 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.03 -0.987 . . . . 52.329999999999998 111.192 -178.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -168.38 -28.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.448 -0.342 . . . . 74.129999999999995 111.051 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 176.98 127.36 1.04 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.571 -0.823 . . . . 73.209999999999994 112.383 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.0 t -159.45 165.31 33.38 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.505 -0.554 . . . . 65.519999999999996 109.505 178.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.0 mp -84.41 113.8 21.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.991 0.424 . . . . 64.209999999999994 110.764 -178.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.99 98.07 0.2 Allowed Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 120.908 -0.663 . . . . 43.539999999999999 111.761 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.418 HG11 ' HB3' ' A' ' 30' ' ' ASN . 61.3 t -95.14 122.05 46.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.9 -0.407 . . . . 64.209999999999994 109.9 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.3 mp -84.42 119.51 73.14 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.335 -0.393 . . . . 51.520000000000003 109.973 179.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -61.85 102.27 0.24 Allowed 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.761 2.307 . . . . 52.409999999999997 111.656 177.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.404 ' HD2' HD13 ' A' ' 35' ' ' LEU . 40.3 ttm180 -105.58 112.48 25.58 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.647 -0.706 . . . . 74.510000000000005 110.212 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.415 ' HG3' ' OE1' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -115.39 158.97 21.7 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.007 -0.542 . . . . 62.509999999999998 109.842 176.799 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.441 ' HA ' HG12 ' A' ' 51' ' ' VAL . 21.4 t -109.24 118.09 55.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.406 -0.361 . . . . 74.239999999999995 110.747 -175.324 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.544 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.3 mp -107.88 132.49 53.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.206 -0.452 . . . . 71.420000000000002 109.794 177.194 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.3 m -92.77 142.86 12.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 120.878 0.37 . . . . 43.509999999999998 110.738 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -88.18 61.2 6.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 74.230000000000004 110.477 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 55.85 -169.25 0.09 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.215 -0.902 . . . . 64.439999999999998 112.217 178.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.4 t70 64.32 -72.59 0.06 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.924 0.889 . . . . 65.109999999999999 112.328 177.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.608 ' OD1' ' HA3' ' A' ' 79' ' ' GLY . 0.4 OUTLIER -88.93 36.53 0.81 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.187 0.517 . . . . 73.019999999999996 110.577 -175.473 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.39 -51.18 70.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.617 -0.719 . . . . 75.310000000000002 110.419 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.41 -27.72 62.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.714 -0.675 . . . . 63.32 110.244 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.608 ' HA3' ' OD1' ' A' ' 76' ' ' ASP . . . -61.67 -52.87 47.94 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.649 -0.705 . . . . 60.009999999999998 112.424 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.96 97.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.629 0.252 . . . . 71.439999999999998 111.088 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 81.4 mtp180 -59.16 -41.85 89.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.094 0.473 . . . . 64.209999999999994 110.63 178.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.464 ' HA ' ' HE ' ' A' ' 82' ' ' ARG . 0.3 OUTLIER -68.89 -49.62 56.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.621 -0.718 . . . . 61.119999999999997 110.809 179.545 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 49.6 tp -56.27 -48.99 75.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.519 -0.764 . . . . 74.510000000000005 112.074 -173.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.555 HD21 HG13 ' A' ' 38' ' ' VAL . 11.1 mp -67.66 -27.37 66.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.651 -0.249 . . . . 74.019999999999996 111.211 -178.602 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.762 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.2 m -70.97 -43.48 67.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.396 -0.365 . . . . 74.239999999999995 110.264 175.114 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -62.77 -39.79 95.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.999 -0.546 . . . . 72.099999999999994 110.764 176.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.86 -43.47 85.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.801 -0.636 . . . . 75.409999999999997 111.465 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 140.08 -43.37 1.14 Allowed Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 119.939 -1.124 . . . . 73.200000000000003 113.433 176.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.873 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -58.93 -75.94 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.654 0.242 . . . . 74.219999999999999 111.654 -175.299 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.873 ' H ' ' HG ' ' A' ' 89' ' ' LEU . . . 44.69 44.46 7.49 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 122.772 0.429 . . . . 54.420000000000002 111.548 -177.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -116.55 -56.02 2.32 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.893 -0.323 . . . . 74.239999999999995 111.467 -173.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -76.81 10.25 2.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.299 -0.41 . . . . 73.120000000000005 111.235 -177.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.782 HD23 ' HB3' ' A' ' 27' ' ' LEU . 63.2 mt -80.52 117.8 21.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.433 . . . . 70.129999999999995 110.273 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -99.64 79.17 2.22 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.226 -0.657 . . . . 73.219999999999999 109.226 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -63.14 -31.15 72.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.38 -0.827 . . . . 52.219999999999999 111.497 -175.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -167.14 -38.46 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.158 0.504 . . . . 73.200000000000003 110.362 179.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.591 -0.718 . . . . 73.239999999999995 110.313 -178.281 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttp . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.76 0.314 . . . . 62.240000000000002 110.542 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.24 86.59 1.86 Allowed Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.8 -0.714 . . . . 72.099999999999994 111.707 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.1 m -116.06 118.56 33.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.779 0.323 . . . . 51.329999999999998 110.844 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.6 m -104.39 114.07 28.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.638 -0.504 . . . . 43.329999999999998 109.638 176.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -137.84 105.78 5.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.238 0.542 . . . . 73.420000000000002 111.624 -176.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -142.99 95.0 2.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.45 -0.795 . . . . 73.310000000000002 109.802 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -75.14 149.52 39.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.467 -0.788 . . . . 75.519999999999996 110.904 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -167.91 128.94 1.41 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.218 0.532 . . . . 73.310000000000002 111.061 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.5 p-80 -145.22 75.92 1.46 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.795 0.807 . . . . 71.420000000000002 109.754 175.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -81.54 87.59 6.23 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.737 -0.665 . . . . 65.439999999999998 111.571 -171.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.1 m -130.67 123.57 29.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.851 -0.796 . . . . 72.25 108.851 173.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.3 t -135.92 104.31 5.68 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.484 0.55 . . . . 72.409999999999997 112.484 -175.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 72.37 -167.53 53.23 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.285 -0.871 . . . . 75.120000000000005 114.917 167.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -172.99 -176.62 1.44 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.508 -0.846 . . . . 65.530000000000001 108.981 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -143.96 153.13 41.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.354 -0.239 . . . . 75.329999999999998 110.354 177.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -161.82 115.69 1.89 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.099 -0.5 . . . . 61.43 109.794 -179.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.2 mt -114.11 100.77 8.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.174 0.511 . . . . 71.230000000000004 112.066 -175.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -127.37 149.36 50.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.708 -0.678 . . . . 74.420000000000002 109.618 171.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -137.67 131.1 30.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.971 0.415 . . . . 63.109999999999999 110.754 178.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 47.3 tp60 -168.05 87.89 0.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.107 -0.701 . . . . 72.239999999999995 109.107 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.7 78.01 0.24 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.88 -0.676 . . . . 72.349999999999994 113.818 -171.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -141.25 169.88 16.77 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.806 -0.813 . . . . 72.430000000000007 108.806 172.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.553 HD22 HD12 ' A' ' 50' ' ' LEU . 5.8 mp -130.61 130.35 43.88 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.85 -0.426 . . . . 75.030000000000001 109.85 176.543 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -122.06 169.27 11.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.299 -0.41 . . . . 75.109999999999999 110.218 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -67.89 120.72 14.64 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.28 -0.418 . . . . 63.340000000000003 111.384 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.634 HD12 HD22 ' A' ' 27' ' ' LEU . 1.8 tm? -74.62 -36.41 62.94 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 107.254 -1.388 . . . . 54.310000000000002 107.254 169.392 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.634 HD22 HD12 ' A' ' 26' ' ' LEU . 2.5 pt? -176.81 159.99 1.84 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.186 -0.915 . . . . 71.540000000000006 110.195 -175.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.447 ' NH1' ' HB3' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -110.07 112.02 23.74 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.081 -1.081 . . . . 74.439999999999998 108.081 170.125 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.686 HG22 ' H ' ' A' ' 32' ' ' ALA . 11.2 m -85.13 109.22 18.11 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.104 -0.498 . . . . 73.310000000000002 111.237 -171.834 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.447 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.6 OUTLIER -90.51 -15.04 31.49 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.125 -0.694 . . . . 74.340000000000003 109.125 176.569 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -73.14 -32.48 64.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.12 -0.945 . . . . 71.430000000000007 110.873 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.686 ' H ' HG22 ' A' ' 29' ' ' THR . . . 74.25 -40.27 0.45 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.703 0.801 . . . . 73.299999999999997 112.586 178.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.1 t -78.91 -39.99 22.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.051 0.453 . . . . 75.319999999999993 110.805 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.404 ' O ' HG23 ' A' ' 38' ' ' VAL . 55.5 tp -52.79 -39.84 62.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.681 -0.691 . . . . 63.119999999999997 112.266 -178.015 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 4.5 pp -65.23 -25.2 67.58 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 111.651 0.241 . . . . 73.019999999999996 111.651 -175.312 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.1 m -70.67 -34.03 71.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.099 0.476 . . . . 74.040000000000006 109.958 178.215 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.33 -40.91 50.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.974 -0.557 . . . . 73.25 110.044 176.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.425 HG13 HD21 ' A' ' 84' ' ' LEU . 75.1 t -57.24 -36.34 51.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 115.606 -0.725 . . . . 73.140000000000001 110.799 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.99 -46.03 95.41 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.596 -0.729 . . . . 70.439999999999998 112.433 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.34 -26.6 65.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.913 0.387 . . . . 62.200000000000003 111.201 -179.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.32 -52.12 13.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.395 -0.366 . . . . 74.230000000000004 110.977 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.539 HD23 HD23 ' A' ' 83' ' ' LEU . 63.7 mt -69.45 -39.45 77.76 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.218 -0.446 . . . . 75.239999999999995 111.401 -175.053 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -30.54 60.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.586 -0.279 . . . . 60.219999999999999 111.117 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.51 -26.67 73.6 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.038 -0.601 . . . . 63.009999999999998 111.796 177.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.45 5.58 46.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.597 0.237 . . . . 53.210000000000001 110.876 178.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.1 t70 70.61 7.68 6.3 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.84 -0.618 . . . . 74.030000000000001 111.217 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.0 mt -75.2 -45.36 41.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.254 0.549 . . . . 63.119999999999997 110.696 -178.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.01 148.21 23.86 Favored Glycine 0 C--N 1.315 -0.588 0 CA-C-N 115.285 -0.871 . . . . 50.229999999999997 111.854 -179.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -142.66 139.78 31.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.291 -0.263 . . . . 70.530000000000001 110.291 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.553 HD12 HD22 ' A' ' 23' ' ' LEU . 71.0 mt -119.02 106.73 12.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.826 0.346 . . . . 72.409999999999997 110.469 175.574 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.599 HG22 HG22 ' A' ' 70' ' ' VAL . 59.0 t -84.71 112.78 22.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.046 -0.724 . . . . 75.349999999999994 109.046 174.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 50.3 tp -105.94 114.39 28.51 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.021 -0.536 . . . . 64.329999999999998 110.834 -175.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.411 ' CB ' ' HG2' ' A' ' 68' ' ' ARG . 8.5 p-10 -155.94 -170.22 3.33 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.311 -0.859 . . . . 75.329999999999998 109.279 176.054 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -99.88 100.2 11.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.025 0.441 . . . . 64.019999999999996 109.998 179.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -81.96 35.61 0.43 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.033 -0.53 . . . . 53.130000000000003 111.412 -174.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.404 ' O ' ' HG2' ' A' ' 56' ' ' MET . 22.3 ttt -155.18 20.24 0.43 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.186 0.517 . . . . 63.229999999999997 110.516 179.302 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.3 m -75.1 113.0 11.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.092 0.473 . . . . 72.510000000000005 110.533 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 5.4 tp -114.03 103.51 15.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.775 0.797 . . . . 74.219999999999999 110.653 -179.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 59' ' ' LEU . 1.0 OUTLIER -122.8 130.68 53.19 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.324 -0.991 . . . . 74.010000000000005 108.324 177.87 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.417 ' N ' HD13 ' A' ' 59' ' ' LEU . 7.5 pt-20 -65.2 97.51 0.26 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.646 0.736 . . . . 74.530000000000001 111.602 -178.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 139.13 156.69 7.06 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.353 -0.839 . . . . 51.299999999999997 111.842 178.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.5 m -96.69 82.76 3.35 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.374 0.607 . . . . 73.519999999999996 110.34 179.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.6 tp -139.5 116.24 10.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.515 -0.766 . . . . 72.129999999999995 109.953 -177.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.88 102.45 2.14 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.864 -0.684 . . . . 40.25 111.968 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.4 t -116.39 -0.05 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.361 0.6 . . . . 71.510000000000005 110.327 -178.553 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.403 HD12 ' N ' ' A' ' 66' ' ' ILE . 4.0 mp -101.47 107.67 52.09 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 74.420000000000002 110.212 -178.4 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.2 93.22 0.89 Allowed 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.407 2.072 . . . . 75.340000000000003 111.464 176.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.411 ' HG2' ' CB ' ' A' ' 53' ' ' ASP . 86.7 mtt180 -72.58 133.55 44.77 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.707 -0.679 . . . . 64.109999999999999 110.223 -177.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 57.2 mtt85 -113.97 135.1 54.37 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.999 -0.546 . . . . 72.329999999999998 111.765 -171.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.599 HG22 HG22 ' A' ' 51' ' ' VAL . 45.0 t -101.98 116.55 45.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.913 -0.585 . . . . 73.209999999999994 109.666 177.047 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mp -101.95 142.98 32.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.793 0.33 . . . . 53.340000000000003 110.546 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.447 HG23 ' HB2' ' A' ' 26' ' ' LEU . 3.0 t -126.29 154.25 35.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.9 -0.591 . . . . 45.109999999999999 109.882 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -59.14 139.06 57.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.99 -0.55 . . . . 73.540000000000006 109.637 174.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.411 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 38.1 mt-10 -57.53 156.43 8.16 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.969 -0.292 . . . . 71.129999999999995 110.387 178.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.411 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 28.7 t70 73.05 -47.5 0.67 Allowed 'General case' 0 N--CA 1.468 0.471 0 O-C-N 123.935 0.772 . . . . 54.530000000000001 110.376 -173.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -73.85 -16.13 61.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.787 -0.82 . . . . 64.439999999999998 108.787 175.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.425 HD22 HD23 ' A' ' 26' ' ' LEU . 1.1 tm? -55.57 -45.83 77.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.524 -1.216 . . . . 72.209999999999994 109.659 174.584 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.06 -38.16 89.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 71.329999999999998 110.987 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.62 -44.41 82.13 Favored Glycine 0 C--N 1.329 0.181 0 C-N-CA 120.971 -0.633 . . . . 61.43 111.829 177.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.408 ' O ' ' HG ' ' A' ' 84' ' ' LEU . . . -59.54 -39.78 85.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.77 0.319 . . . . 14.43 110.683 177.281 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.4 mtp180 -55.35 -52.91 61.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.89 -0.596 . . . . 75.329999999999998 110.947 176.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -62.3 -43.49 98.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 75.329999999999998 110.754 -177.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.539 HD23 HD23 ' A' ' 42' ' ' LEU . 50.1 tp -59.28 -47.11 86.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.641 -0.708 . . . . 74.450000000000003 111.035 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.425 HD21 HG13 ' A' ' 38' ' ' VAL . 66.4 mt -72.01 -26.11 62.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.073 -0.512 . . . . 75.340000000000003 111.588 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 56.4 m -68.0 -48.3 66.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.584 -0.28 . . . . 75.040000000000006 110.423 176.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -65.64 -42.09 91.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.86 0.362 . . . . 73.439999999999998 110.698 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -119.42 82.21 1.84 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.099 0.476 . . . . 71.329999999999998 111.136 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 154.3 -95.69 0.15 Allowed Glycine 0 N--CA 1.44 -1.091 0 N-CA-C 111.384 -0.686 . . . . 34.130000000000003 111.384 178.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.559 HD12 ' N ' ' A' ' 90' ' ' ALA . 1.7 pp 175.12 -35.28 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.763 0.425 . . . . 62.520000000000003 110.662 -177.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ALA . . . . . 0.559 ' N ' HD12 ' A' ' 89' ' ' LEU . . . 48.39 54.12 10.9 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.707 -0.679 . . . . 61.299999999999997 112.185 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -99.8 -34.64 10.07 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.642 0.258 . . . . 74.150000000000006 110.879 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.474 ' HA ' ' HB2' ' A' ' 96' ' ' ASP . 43.9 mt-10 -82.09 24.44 0.65 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.344 -0.389 . . . . 64.549999999999997 111.786 -175.433 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.405 HD21 ' HB1' ' A' ' 90' ' ' ALA . 94.2 mt -50.09 117.51 2.38 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.372 0.42 . . . . 71.310000000000002 111.83 -175.084 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.409 ' N ' ' HA ' ' A' ' 27' ' ' LEU . 79.2 mtt180 64.01 -78.47 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 O-C-N 124.048 0.842 . . . . 74.329999999999998 110.947 -172.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 8.9 p -138.52 134.67 34.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.277 -0.42 . . . . 71.310000000000002 110.157 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ASP . . . . . 0.474 ' HB2' ' HA ' ' A' ' 92' ' ' GLU . 13.3 t70 -103.69 6.23 36.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.664 0.745 . . . . 75.510000000000005 109.533 179.481 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.435 ' CG ' HH21 ' A' ' 28' ' ' ARG . 35.8 m-20 . . . . . 0 C--O 1.248 0.981 0 CA-C-N 114.994 -1.003 . . . . 71.140000000000001 109.564 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.0 mtp . . . . . 0 N--CA 1.478 0.968 0 CA-C-O 120.714 0.293 . . . . 72.530000000000001 110.531 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 117.64 90.02 1.42 Allowed Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.821 -0.704 . . . . 50.350000000000001 111.968 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.6 p -66.61 158.08 30.81 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.884 0.374 . . . . 75.530000000000001 110.78 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 m -76.2 97.49 4.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.936 0.398 . . . . 74.319999999999993 110.722 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -90.33 93.64 9.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 53.530000000000001 109.899 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -123.02 99.27 6.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.181 -0.463 . . . . 72.510000000000005 110.11 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 74.9 m-70 -110.49 169.41 8.76 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.067 -0.716 . . . . 73.420000000000002 109.067 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -153.56 130.83 11.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.262 0.554 . . . . 73.25 111.097 178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -142.99 113.12 7.17 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.445 -0.798 . . . . 45.32 109.101 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -103.68 112.03 24.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.035 0.445 . . . . 73.310000000000002 110.652 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.1 m -150.65 117.94 6.02 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.714 -0.676 . . . . 62.530000000000001 110.406 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -134.68 88.7 2.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.078 -0.51 . . . . 64.439999999999998 109.928 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -131.67 58.0 0.71 Allowed Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 111.373 -0.691 . . . . 40.310000000000002 111.373 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.89 76.3 8.71 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.638 -0.504 . . . . 71.299999999999997 109.638 -176.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.89 -0.595 . . . . 74.099999999999994 110.736 -177.678 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.7 mt . . . . . 0 C--O 1.231 0.129 0 CA-C-O 121.028 0.442 . . . . 65.209999999999994 111.649 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.891 ' HB2' HD21 ' A' ' 77' ' ' LEU . 50.7 mtt180 -134.4 148.03 50.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.974 -0.557 . . . . 72.439999999999998 109.729 173.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.84 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 25.1 tt0 -81.94 136.58 35.29 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.038 -0.528 . . . . 70.109999999999999 110.701 -177.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.676 HD11 HG22 ' A' ' 72' ' ' VAL . 11.2 mp -106.77 -65.86 1.06 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.634 0.254 . . . . 63.329999999999998 111.521 -179.12 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -147.0 177.21 9.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.733 0.301 . . . . 74.140000000000001 110.925 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' HB ' ' A' ' 29' ' ' THR . 6.2 ptp180 -148.46 154.28 39.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.319 -0.4 . . . . 73.109999999999999 110.223 -178.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.461 HG21 HD23 ' A' ' 34' ' ' LEU . 12.2 t 178.29 163.61 0.7 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.377 0.423 . . . . 74.239999999999995 110.121 176.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -113.95 -0.17 14.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.009 0.433 . . . . 74.430000000000007 109.834 175.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -73.77 116.51 14.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.755 -0.657 . . . . 72.129999999999995 110.576 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.56 -33.8 74.48 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.55 -0.75 . . . . 54.210000000000001 112.239 -176.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 65.7 t -72.34 -47.53 52.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.818 0.342 . . . . 72.049999999999997 110.25 -178.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.461 HD23 HG21 ' A' ' 29' ' ' THR . 40.2 tp -61.38 -40.83 95.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 75.129999999999995 110.426 178.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.581 HD13 ' HD2' ' A' ' 68' ' ' ARG . 69.9 mt -65.26 -29.17 69.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.959 -0.564 . . . . 72.549999999999997 111.356 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.1 m -76.05 -39.08 56.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.715 0.293 . . . . 62.530000000000001 110.528 177.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.457 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -64.43 -53.89 41.33 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.194 -0.457 . . . . 70.219999999999999 110.935 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.8 t -60.53 -38.25 77.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.066 -0.515 . . . . 63.5 110.884 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.55 -48.39 82.14 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.897 -0.592 . . . . 70.299999999999997 111.918 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.63 -34.66 77.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.714 0.293 . . . . 62.109999999999999 111.629 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 96.2 mt -64.6 -51.48 62.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.14 -0.482 . . . . 75.030000000000001 110.639 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.13 -41.36 74.02 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.93 -0.577 . . . . 74.109999999999999 110.984 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.74 -39.44 91.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.899 -0.591 . . . . 74.120000000000005 110.821 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.0 -25.04 71.95 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.122 -0.561 . . . . 72.109999999999999 112.822 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -102.05 7.98 41.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.542 0.211 . . . . 70.129999999999995 111.412 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.8 t70 61.41 30.55 18.98 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.539 0.685 . . . . 74.140000000000001 110.903 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.59 HG21 ' HB2' ' A' ' 80' ' ' ALA . 72.0 mt -85.13 121.18 36.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.298 -0.41 . . . . 62.0 110.347 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -62.63 107.98 1.89 Allowed Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.5 -0.64 . . . . 64.400000000000006 111.5 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' VAL . 52.1 p-80 -126.72 166.65 16.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.91 0.386 . . . . 61.310000000000002 111.48 -173.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.5 tp -138.58 104.61 5.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.347 -0.842 . . . . 71.120000000000005 109.676 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.595 HG12 HG22 ' A' ' 70' ' ' VAL . 29.5 m . . . . . 0 C--N 1.323 -0.565 0 CA-C-O 121.506 0.669 . . . . 62.140000000000001 110.141 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo . . . . . 0 N--CA 1.453 -0.874 0 CA-C-O 120.764 0.235 . . . . 71.239999999999995 112.08 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.581 ' HD2' HD13 ' A' ' 35' ' ' LEU . 66.3 mtt180 -104.39 160.61 14.77 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.121 -0.326 . . . . 71.439999999999998 110.121 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.8 ptt180 -133.68 140.8 47.27 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.64 -0.504 . . . . 72.129999999999995 109.64 176.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.595 HG22 HG12 ' A' ' 51' ' ' VAL . 48.5 t -103.63 116.38 47.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.907 -0.588 . . . . 60.0 111.253 -173.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.84 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.4 mp -117.84 162.14 18.59 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.107 -0.701 . . . . 75.019999999999996 109.107 173.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.676 HG22 HD11 ' A' ' 26' ' ' LEU . 35.2 m -137.34 167.41 23.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 120.824 0.345 . . . . 53.140000000000001 110.104 174.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -73.13 137.55 45.24 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.223 -0.658 . . . . 63.219999999999999 109.223 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.816 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 40.9 mt-10 -65.26 -11.15 38.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.657 0.265 . . . . 72.200000000000003 111.584 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -55.59 -39.25 70.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.605 0.717 . . . . 75.200000000000003 110.009 171.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -129.43 33.81 4.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.338 -0.846 . . . . 70.129999999999995 110.215 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.891 HD21 ' HB2' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -56.52 -57.08 13.9 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.656 -0.702 . . . . 64.129999999999995 110.415 -177.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.49 70.36 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.841 -0.618 . . . . 61.25 110.996 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -68.97 -46.77 58.24 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 121.183 -0.532 . . . . 73.140000000000001 112.659 -178.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.59 ' HB2' HG21 ' A' ' 47' ' ' ILE . . . -63.58 -44.4 94.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.739 0.304 . . . . 63.530000000000001 110.862 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 57.2 mtp85 -67.39 -33.32 74.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.443 . . . . 73.230000000000004 110.401 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -62.01 -47.29 85.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.829 -0.623 . . . . 73.329999999999998 109.788 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.5 tp -60.37 -53.19 60.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 75.329999999999998 110.981 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.47 -28.81 68.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.12 -0.491 . . . . 62.219999999999999 112.001 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.768 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 47.4 m -85.26 -48.66 8.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.812 0.339 . . . . 71.349999999999994 111.213 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -74.19 -43.88 55.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.223 -0.444 . . . . 72.230000000000004 111.9 -173.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.54 29.99 4.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.853 0.359 . . . . 64.129999999999995 111.662 -174.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -121.35 -80.0 0.56 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.182 -1.009 . . . . 65.540000000000006 112.306 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.47 HD12 ' N ' ' A' ' 90' ' ' ALA . 1.8 pp -167.58 -44.5 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.873 -0.163 . . . . 75.319999999999993 111.273 -177.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.768 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 55.96 94.67 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.724 0.64 . . . . 70.239999999999995 111.704 -178.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -157.64 -64.96 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.523 -0.471 . . . . 72.120000000000005 111.234 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -87.52 16.87 5.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.211 -0.45 . . . . 74.450000000000003 111.824 -172.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 98.8 mt -73.72 126.17 29.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.131 0.491 . . . . 71.530000000000001 111.615 -175.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 115.468 -0.787 . . . . 61.030000000000001 109.152 178.064 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.7 ttp . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 110.176 -0.305 . . . . 74.450000000000003 110.176 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.62 119.24 2.63 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.684 -0.769 . . . . 63.399999999999999 111.993 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.3 t -139.12 97.81 3.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.155 0.502 . . . . 72.25 109.693 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 t -89.78 85.47 6.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.331 -0.618 . . . . 52.43 109.331 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -131.51 70.77 1.46 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.558 0.694 . . . . 74.420000000000002 110.291 -177.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -125.93 87.54 2.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.641 0.734 . . . . 70.310000000000002 110.828 -178.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.6 p-80 -126.03 37.91 4.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.754 -0.657 . . . . 75.319999999999993 109.848 176.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -70.91 77.94 0.64 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.7 -0.852 . . . . 73.219999999999999 108.7 175.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 37.7 t-80 -122.19 107.85 12.63 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.408 -0.814 . . . . 71.5 109.694 -173.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -130.28 95.43 3.9 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.561 -0.533 . . . . 62.450000000000003 109.561 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.6 t -129.49 113.97 15.54 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.169 -0.469 . . . . 62.130000000000003 109.775 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.2 t -151.3 112.19 4.27 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.183 -0.462 . . . . 61.329999999999998 110.266 178.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 84.38 65.26 1.53 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.908 -0.663 . . . . 63.43 112.7 177.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.42 ' HD2' ' OD1' ' A' ' 76' ' ' ASP . 51.2 ttp85 -77.25 94.91 4.21 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.869 -0.789 . . . . 74.299999999999997 108.869 177.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 116.214 -0.448 . . . . 72.329999999999998 112.021 -171.445 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.627 HD13 HD22 ' A' ' 50' ' ' LEU . 14.1 mt . . . . . 0 N--CA 1.452 -0.36 0 N-CA-C 110.084 -0.339 . . . . 73.299999999999997 110.084 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.623 ' HB2' HD21 ' A' ' 77' ' ' LEU . 17.5 mmt180 -113.84 133.38 55.45 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.228 -0.442 . . . . 73.439999999999998 110.419 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.663 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 29.6 tt0 -64.83 109.06 1.94 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.721 -0.844 . . . . 71.030000000000001 108.721 175.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.7 tp -87.16 -54.81 4.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.425 -0.352 . . . . 74.099999999999994 110.811 -172.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.58 157.06 43.21 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.282 -0.417 . . . . 73.109999999999999 110.102 177.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.428 ' HG3' ' HB3' ' A' ' 69' ' ' ARG . 39.9 ttp180 -142.73 119.95 11.51 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.628 -0.508 . . . . 72.400000000000006 109.628 179.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -148.91 160.55 43.16 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.107 -0.331 . . . . 64.109999999999999 110.107 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -107.56 10.28 29.26 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.395 -0.366 . . . . 71.349999999999994 110.531 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -92.51 107.51 19.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.382 -0.372 . . . . 72.150000000000006 110.066 177.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.98 -27.15 68.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.953 -0.567 . . . . 72.219999999999999 111.896 -175.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 44.2 t -66.85 -50.91 60.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.861 0.362 . . . . 73.340000000000003 110.477 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.716 HD11 HD22 ' A' ' 89' ' ' LEU . 23.1 tp -64.27 -38.68 91.91 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.979 -0.555 . . . . 63.509999999999998 110.323 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.458 HD13 ' HD2' ' A' ' 68' ' ' ARG . 77.7 mt -61.25 -32.9 72.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.96 -0.564 . . . . 62.039999999999999 111.047 177.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -70.02 -39.27 75.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.905 0.383 . . . . 61.119999999999997 110.559 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.508 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.19 -52.8 52.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 73.129999999999995 110.459 178.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.522 HG13 HD21 ' A' ' 84' ' ' LEU . 86.3 t -60.12 -40.36 83.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.895 -0.593 . . . . 72.010000000000005 110.428 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 43' ' ' ASP . . . -61.7 -49.32 77.56 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.601 -0.727 . . . . 54.149999999999999 112.264 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.37 -31.53 72.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.699 0.285 . . . . 73.120000000000005 111.295 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.701 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.7 mt -64.61 -51.75 61.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.219 -0.446 . . . . 74.400000000000006 110.702 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.1 mt -71.94 -40.05 68.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.104 -0.498 . . . . 45.420000000000002 110.832 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 39' ' ' GLY . 0.8 OUTLIER -66.5 -35.98 81.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.125 0.488 . . . . 71.219999999999999 110.35 -177.379 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -73.14 -35.51 57.24 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.855 -0.688 . . . . 63.109999999999999 112.378 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.15 -1.0 57.02 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.501 0.185 . . . . 73.340000000000003 111.501 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.4 t70 71.24 28.16 3.07 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.753 0.658 . . . . 55.530000000000001 110.857 177.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -84.02 128.31 38.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.167 -0.47 . . . . 73.439999999999998 110.193 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.81 110.82 3.7 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.064 -0.588 . . . . 65.239999999999995 111.978 -177.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -109.21 130.85 55.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.013 0.435 . . . . 74.140000000000001 111.436 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.627 HD22 HD13 ' A' ' 23' ' ' LEU . 60.8 tp -98.39 102.8 14.65 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.89 -0.782 . . . . 75.439999999999998 108.89 171.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.451 HG12 HG22 ' A' ' 70' ' ' VAL . 6.4 m . . . . . 0 C--N 1.322 -0.613 0 CA-C-N 116.127 -0.488 . . . . 74.400000000000006 110.553 -175.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo . . . . . 0 N--CA 1.46 -0.496 0 N-CA-C 111.092 -0.388 . . . . 70.109999999999999 111.092 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.458 ' HD2' HD13 ' A' ' 35' ' ' LEU . 27.7 ttm180 -66.8 122.69 18.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.036 -0.529 . . . . 73.25 110.289 -177.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.428 ' HB3' ' HG3' ' A' ' 28' ' ' ARG . 19.3 ptt180 -113.27 152.12 30.23 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.727 -0.669 . . . . 75.450000000000003 110.449 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.451 HG22 HG12 ' A' ' 51' ' ' VAL . 29.8 t -112.98 117.51 55.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.683 -0.689 . . . . 74.209999999999994 110.104 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.663 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 7.5 mp -107.86 137.7 45.4 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.013 -0.365 . . . . 71.150000000000006 110.013 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.487 HG23 HD22 ' A' ' 77' ' ' LEU . 14.5 m -132.39 166.07 30.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.143 -0.48 . . . . 61.109999999999999 110.338 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -76.07 156.56 33.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.434 -0.348 . . . . 74.010000000000005 110.451 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.638 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 57.7 mp0 -59.97 -21.89 61.8 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.324 -0.398 . . . . 73.450000000000003 110.908 174.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -52.19 -71.41 0.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.854 -0.612 . . . . 74.400000000000006 110.737 176.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.42 ' OD1' ' HD2' ' A' ' 14' ' ' ARG . 44.5 m-20 -91.38 18.0 7.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.657 -0.701 . . . . 64.329999999999998 110.653 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.638 ' HB2' ' HA ' ' A' ' 74' ' ' GLU . 0.3 OUTLIER -56.87 -51.18 70.07 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.559 -0.534 . . . . 70.510000000000005 109.559 179.242 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.59 -32.48 72.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.602 -0.727 . . . . 62.130000000000003 110.991 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.42 -45.96 43.94 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.069 -0.586 . . . . 74.430000000000007 112.334 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.6 -40.21 95.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.59 0.233 . . . . 54.240000000000002 110.558 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -59.13 -45.03 91.99 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.847 0.356 . . . . 62.509999999999998 110.132 175.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.47 -50.9 72.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.779 -0.646 . . . . 74.099999999999994 110.553 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.701 HD21 ' HB3' ' A' ' 41' ' ' LEU . 55.8 tp -58.61 -52.96 63.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.772 -0.649 . . . . 71.230000000000004 111.257 -177.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.522 HD21 HG13 ' A' ' 38' ' ' VAL . 85.6 mt -66.54 -28.26 68.4 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.226 -0.443 . . . . 72.319999999999993 111.944 -177.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.863 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 90.6 m -82.45 -50.18 9.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.826 0.346 . . . . 64.450000000000003 111.14 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -72.93 -44.13 61.56 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.338 0.495 . . . . 75.310000000000002 112.338 -173.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -121.76 7.26 9.93 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.827 0.677 . . . . 73.209999999999994 112.827 -172.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -111.41 -74.96 0.76 Allowed Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 119.915 -1.136 . . . . 71.310000000000002 112.288 -178.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.716 HD22 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -172.61 -51.89 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.526 0.203 . . . . 74.299999999999997 111.203 -172.357 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.863 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 59.2 82.98 0.14 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.905 -0.589 . . . . 54.43 110.74 -172.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -158.79 -44.59 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.03 0.443 . . . . 74.109999999999999 110.796 -176.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -89.91 11.11 21.35 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.071 -0.513 . . . . 71.120000000000005 110.819 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 90.9 mt -71.17 133.0 45.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 63.109999999999999 110.911 -176.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 115.798 -0.637 . . . . 73.510000000000005 110.679 178.659 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.835 0.35 . . . . 53.109999999999999 110.207 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 81.3 -172.4 53.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.751 -0.738 . . . . 52.420000000000002 111.783 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.0 p -141.08 148.28 39.92 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.005 0.402 . . . . 72.439999999999998 110.784 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.2 p -87.0 133.19 33.6 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.041 -0.527 . . . . 71.120000000000005 110.563 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -124.34 116.26 22.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.512 0.672 . . . . 71.540000000000006 111.231 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -145.33 106.57 4.19 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.289 -0.869 . . . . 63.549999999999997 109.715 175.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -127.75 107.25 9.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.488 -0.324 . . . . 73.230000000000004 111.26 -176.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -144.27 146.45 32.64 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.401 -0.592 . . . . 71.010000000000005 109.401 172.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -156.02 118.42 4.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.131 0.491 . . . . 73.450000000000003 111.673 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -145.45 94.17 2.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.74 0.781 . . . . 62.399999999999999 109.923 168.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.1 t -130.65 102.18 6.01 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.356 -0.838 . . . . 64.219999999999999 109.493 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.7 t -149.35 155.34 40.35 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.485 -0.561 . . . . 64.230000000000004 109.485 -176.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 158.97 99.1 0.15 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.909 -0.663 . . . . 74.030000000000001 111.881 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -95.24 -26.91 15.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.917 0.389 . . . . 75.019999999999996 110.487 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 . . . . . 0 C--N 1.327 -0.41 0 CA-C-O 121.222 0.534 . . . . 72.239999999999995 110.326 -179.718 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 73' ' ' HIS . 8.5 mp . . . . . 0 N--CA 1.45 -0.435 0 N-CA-C 109.057 -0.72 . . . . 62.509999999999998 109.057 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -105.3 142.52 34.93 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.407 -0.361 . . . . 73.140000000000001 110.229 -177.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.785 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 28.9 tt0 -76.12 109.07 9.48 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.472 -0.936 . . . . 75.329999999999998 108.472 176.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.422 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -81.82 -70.17 0.56 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.131 -0.486 . . . . 75.400000000000006 112.04 -169.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.499 ' HB2' ' O ' ' A' ' 92' ' ' GLU . 0.9 OUTLIER -142.38 170.28 15.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.192 0.52 . . . . 74.340000000000003 112.225 -169.645 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.564 ' O ' ' HB3' ' A' ' 92' ' ' GLU . 6.4 ptp180 -138.34 158.04 45.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.881 -1.054 . . . . 73.530000000000001 109.0 177.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.8 t -161.21 163.03 31.4 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.05 -0.352 . . . . 62.32 110.05 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -116.02 11.41 15.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.141 -0.481 . . . . 75.129999999999995 110.363 -174.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.401 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 28.4 t70 -120.41 135.51 55.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.168 -0.469 . . . . 72.109999999999999 111.223 -177.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.21 -31.78 64.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.82 -0.627 . . . . 65.430000000000007 111.522 -176.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.4 t -69.87 -43.43 79.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.621 -0.511 . . . . 71.450000000000003 109.621 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.401 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 9.2 mp -58.84 -48.35 81.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.571 -0.741 . . . . 72.109999999999999 110.846 175.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.6 mt -52.79 -41.72 64.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.929 -0.578 . . . . 75.299999999999997 111.381 175.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.9 m -72.71 -41.63 65.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.226 -0.443 . . . . 65.409999999999997 111.092 -178.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -64.05 -54.22 37.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.481 -0.327 . . . . 51.119999999999997 110.649 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.696 HG13 HD22 ' A' ' 84' ' ' LEU . 87.8 t -61.02 -40.46 85.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.147 0.499 . . . . 75.319999999999993 110.607 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.17 -52.04 50.43 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 115.702 -0.681 . . . . 71.019999999999996 112.528 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.33 -31.8 67.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.671 0.272 . . . . 61.219999999999999 111.485 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 94.2 mt -63.15 -51.24 67.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.334 -0.394 . . . . 61.350000000000001 110.341 177.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.4 mt -68.25 -36.8 80.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.836 -0.62 . . . . 73.439999999999998 110.652 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -64.4 -46.84 81.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 71.010000000000005 110.53 177.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.47 -36.97 93.25 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.794 -0.639 . . . . 62.509999999999998 112.93 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.97 -10.72 59.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.012 0.434 . . . . 74.519999999999996 110.81 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.4 t70 70.32 23.71 4.96 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 115.061 -0.972 . . . . 63.210000000000001 110.635 178.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.9 mt -74.32 -39.34 48.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.701 -0.682 . . . . 71.140000000000001 109.485 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.19 110.68 0.33 Allowed Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 114.928 -1.033 . . . . 70.209999999999994 112.077 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -91.71 150.79 20.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.826 0.346 . . . . 60.509999999999998 110.884 -177.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.4 tp -114.09 87.31 2.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.785 -0.82 . . . . 71.129999999999995 108.785 170.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.694 HG12 HG22 ' A' ' 70' ' ' VAL . 6.3 m . . . . . 0 C--N 1.323 -0.549 0 CA-C-O 121.521 0.677 . . . . 62.009999999999998 110.892 -176.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo . . . . . 0 C--O 1.234 0.321 0 CA-C-O 120.793 0.247 . . . . 74.400000000000006 111.854 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -69.0 139.81 55.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.321 -0.4 . . . . 74.230000000000004 110.222 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 63.2 mtt180 -114.1 155.22 26.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.198 -0.455 . . . . 74.299999999999997 110.275 -176.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.694 HG22 HG12 ' A' ' 51' ' ' VAL . 31.6 t -113.02 120.83 64.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.254 -0.43 . . . . 72.420000000000002 110.356 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.785 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.8 mp -114.89 143.52 45.0 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.609 0.242 . . . . 64.239999999999995 110.826 177.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.0 m -142.35 160.84 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 116.179 -0.464 . . . . 74.230000000000004 110.112 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.519 ' HA ' ' HA ' ' A' ' 23' ' ' LEU . 2.0 p-80 -72.48 143.3 48.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.149 0.499 . . . . 74.310000000000002 111.255 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.898 ' HA ' HD23 ' A' ' 77' ' ' LEU . 31.1 tt0 -57.1 -37.01 71.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.056 -0.974 . . . . 63.229999999999997 113.059 -169.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -64.17 -18.95 64.96 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.33 0.492 . . . . 63.020000000000003 112.33 -171.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -117.12 15.22 15.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.019 0.438 . . . . 73.129999999999995 110.869 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.898 HD23 ' HA ' ' A' ' 74' ' ' GLU . 0.6 OUTLIER -58.96 -41.12 86.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.744 -0.662 . . . . 54.43 110.451 177.383 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.07 -40.33 80.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.913 -0.585 . . . . 75.219999999999999 111.187 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.91 -47.3 25.73 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.58 -0.819 . . . . 61.130000000000003 112.268 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.462 ' O ' ' HG ' ' A' ' 84' ' ' LEU . . . -63.07 -41.82 99.53 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.717 0.266 . . . . 65.549999999999997 111.717 -177.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -58.84 -47.75 83.76 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 120.574 0.226 . . . . 75.510000000000005 110.887 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -56.52 -45.15 81.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.2 0.524 . . . . 75.120000000000005 110.372 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 45.1 tp -64.9 -52.04 58.64 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.474 -0.785 . . . . 74.430000000000007 111.256 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.696 HD22 HG13 ' A' ' 38' ' ' VAL . 76.2 mt -70.41 -28.05 64.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.114 -0.494 . . . . 73.450000000000003 111.883 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.902 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.8 m -75.5 -49.49 18.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.645 0.26 . . . . 53.329999999999998 110.755 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -75.34 -44.15 46.81 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.042 0.386 . . . . 71.519999999999996 112.042 -174.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -115.04 20.15 15.24 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.152 0.427 . . . . 73.340000000000003 112.152 -173.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -125.84 -80.51 0.38 Allowed Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 120.176 -1.011 . . . . 73.219999999999999 111.527 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.618 HD12 ' N ' ' A' ' 90' ' ' ALA . 0.9 OUTLIER 176.77 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.763 0.425 . . . . 73.340000000000003 111.302 -176.827 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.902 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 65.12 7.05 3.83 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.165 0.802 . . . . 75.129999999999995 113.165 177.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -85.49 -33.95 21.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.923 0.392 . . . . 64.400000000000006 110.941 -177.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.564 ' HB3' ' O ' ' A' ' 28' ' ' ARG . 5.7 mm-40 -80.85 1.17 31.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.716 -0.674 . . . . 75.219999999999999 111.161 -174.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 83.7 mt -66.6 115.37 6.38 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.232 -0.44 . . . . 65.540000000000006 111.62 -174.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.422 ' H ' ' HA ' ' A' ' 27' ' ' LEU . 22.3 ttt180 . . . . . 0 N--CA 1.463 0.219 0 CA-C-N 114.916 -1.038 . . . . 75.349999999999994 111.879 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 120.768 0.318 . . . . 70.120000000000005 110.46 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.12 113.89 0.31 Allowed Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.028 -0.606 . . . . 21.440000000000001 111.824 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.4 m -108.18 152.75 24.15 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.418 -0.586 . . . . 62.420000000000002 109.418 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.5 m -77.08 85.93 3.57 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.183 0.516 . . . . 64.120000000000005 110.103 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -89.43 73.42 7.89 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.668 0.747 . . . . 73.230000000000004 110.022 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -145.72 145.16 30.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.262 -0.881 . . . . 75.540000000000006 109.792 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -131.04 114.92 15.78 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.975 -0.557 . . . . 63.450000000000003 109.837 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -79.14 144.73 34.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.863 0.363 . . . . 72.219999999999999 110.527 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -159.53 122.58 3.6 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.459 -0.571 . . . . 63.109999999999999 109.459 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -117.67 114.31 23.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.078 0.466 . . . . 75.109999999999999 110.361 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.9 m -152.52 85.8 1.26 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.616 -0.72 . . . . 62.530000000000001 109.676 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.9 t -162.81 150.85 13.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.768 -0.651 . . . . 33.009999999999998 109.56 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 149.66 149.99 5.14 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.821 -0.704 . . . . 64.030000000000001 112.11 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 70.1 mtp180 -134.92 -175.52 3.93 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.626 0.25 . . . . 75.439999999999998 110.334 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 . . . . . 0 C--N 1.323 -0.573 0 CA-C-N 116.029 -0.532 . . . . 64.340000000000003 109.944 175.823 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.552 ' HG ' ' HD2' ' A' ' 73' ' ' HIS . 5.1 mp . . . . . 0 N--CA 1.454 -0.229 0 CA-C-O 120.688 0.28 . . . . 75.230000000000004 110.285 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.46 ' HB2' HD21 ' A' ' 77' ' ' LEU . 28.4 mmm-85 -133.35 133.84 43.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.039 -0.528 . . . . 74.310000000000002 110.149 -176.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.588 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 71.8 tt0 -68.59 114.74 7.24 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.529 -0.545 . . . . 63.329999999999998 109.529 173.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.508 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -84.72 -54.7 4.53 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.705 -0.48 . . . . 74.319999999999993 109.705 -175.89 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.571 HD11 HG21 ' A' ' 38' ' ' VAL . 2.1 pt? -148.27 160.7 42.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.149 0.5 . . . . 55.140000000000001 110.956 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.499 ' HG3' ' HG2' ' A' ' 69' ' ' ARG . 51.6 ttt180 -141.23 122.7 15.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.469 -0.787 . . . . 71.129999999999995 109.58 -178.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 t -150.26 177.81 9.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.675 0.274 . . . . 74.530000000000001 110.296 -177.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -124.67 -4.03 7.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.126 -0.488 . . . . 71.519999999999996 110.903 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -85.49 125.12 32.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.939 0.4 . . . . 75.219999999999999 110.769 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.6 -41.07 80.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.628 -0.715 . . . . 74.549999999999997 111.677 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.2 t -63.36 -43.26 98.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-O 121.277 0.561 . . . . 73.329999999999998 110.819 -176.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.53 ' CD2' ' HG3' ' A' ' 92' ' ' GLU . 47.6 tp -62.3 -44.46 96.47 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.791 -0.64 . . . . 53.439999999999998 110.798 178.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 68.2 mt -59.41 -39.56 83.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 75.150000000000006 111.266 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.7 m -62.47 -38.72 90.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.837 0.351 . . . . 64.120000000000005 110.958 178.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.455 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -66.83 -48.72 68.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 63.25 110.634 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.571 HG21 HD11 ' A' ' 27' ' ' LEU . 60.4 t -61.32 -39.92 84.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.971 -0.559 . . . . 51.409999999999997 110.6 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.64 -45.59 95.4 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.109 -0.567 . . . . 64.420000000000002 112.46 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.63 -28.98 69.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.904 0.383 . . . . 71.439999999999998 111.388 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 93.3 mt -73.6 -51.47 16.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.141 -0.481 . . . . 63.049999999999997 110.333 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.0 mt -66.66 -39.36 88.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.784 -0.644 . . . . 70.530000000000001 111.11 -176.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -70.18 -36.87 74.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.779 0.323 . . . . 72.310000000000002 110.784 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.45 -32.26 78.7 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.689 -0.767 . . . . 73.450000000000003 112.526 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.06 11.78 26.43 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.504 0.192 . . . . 72.040000000000006 111.466 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.7 t70 59.26 30.15 19.84 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 122.016 0.912 . . . . 70.030000000000001 110.812 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 60.3 mt -83.97 -44.7 18.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.685 -0.688 . . . . 72.010000000000005 109.791 178.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.1 139.34 5.85 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.036 -0.983 . . . . 71.349999999999994 111.253 -175.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -123.75 117.14 24.26 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.101 0.477 . . . . 71.120000000000005 110.628 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.8 mt -101.71 96.51 7.14 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.781 -0.451 . . . . 74.319999999999993 109.781 176.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.7 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 30.6 m . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.097 -0.501 . . . . 64.540000000000006 110.228 178.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo . . . . . 0 N--CA 1.459 -0.514 0 CA-C-O 120.983 0.326 . . . . 75.329999999999998 111.941 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -87.72 133.43 33.85 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.563 -0.532 . . . . 70.099999999999994 109.563 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.7 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 60.1 mtp180 -120.03 137.94 53.8 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.779 -0.646 . . . . 45.25 109.722 -169.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.668 HG22 HG12 ' A' ' 51' ' ' VAL . 8.1 t -99.95 105.94 18.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.823 0.344 . . . . 72.310000000000002 110.728 -171.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.588 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 9.1 mp -104.2 127.7 51.84 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.126 -0.488 . . . . 54.009999999999998 110.58 177.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 29.7 m -109.56 -176.04 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.602 -0.726 . . . . 72.239999999999995 109.648 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.552 ' HD2' ' HG ' ' A' ' 23' ' ' LEU . 43.1 m80 -107.22 162.37 13.94 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.938 -0.305 . . . . 63.140000000000001 110.267 -179.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -59.48 -22.73 62.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.407 0.622 . . . . 75.200000000000003 109.978 173.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -50.25 -36.18 30.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.477 -1.238 . . . . 51.420000000000002 112.684 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -141.49 30.59 1.72 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.853 0.358 . . . . 72.109999999999999 110.605 -175.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.46 HD21 ' HB2' ' A' ' 24' ' ' ARG . 0.2 OUTLIER -57.95 -47.4 83.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.05 0.453 . . . . 65.5 110.593 -177.081 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.29 -40.49 74.23 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.003 -0.544 . . . . 74.049999999999997 111.129 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -66.39 -48.21 65.19 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.903 -0.665 . . . . 74.239999999999995 112.157 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.71 -41.2 77.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.764 0.316 . . . . 71.450000000000003 110.815 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -59.12 -53.98 52.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.353 -0.385 . . . . 72.239999999999995 111.078 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -64.73 -38.21 90.2 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 121.175 -0.21 . . . . 71.409999999999997 111.265 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.3 tp -58.69 -47.98 82.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.077 0.465 . . . . 72.239999999999995 110.708 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.582 ' HG ' HD11 ' A' ' 89' ' ' LEU . 11.1 mp -72.89 -28.67 62.62 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.056 -0.52 . . . . 73.400000000000006 111.213 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.688 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 89.5 m -66.36 -46.14 77.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 110.358 -0.238 . . . . 31.34 110.358 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.62 -31.74 72.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.274 -0.421 . . . . 73.409999999999997 110.72 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.96 -27.06 67.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.067 0.461 . . . . 24.219999999999999 111.115 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.73 -15.83 59.27 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.801 -0.714 . . . . 73.109999999999999 112.493 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.582 HD11 ' HG ' ' A' ' 84' ' ' LEU . 3.2 pp -84.55 9.42 13.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.766 0.317 . . . . 73.200000000000003 111.366 -177.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.688 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . -65.65 86.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.131 0.491 . . . . 65.230000000000004 110.039 174.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -163.77 -37.23 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.4 -0.818 . . . . 71.109999999999999 110.009 -177.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.53 ' HG3' ' CD2' ' A' ' 34' ' ' LEU . 20.8 mm-40 -80.44 4.13 19.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.319 -0.401 . . . . 62.119999999999997 110.91 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.454 ' CD1' ' HA ' ' A' ' 90' ' ' ALA . 10.2 mp -65.61 142.85 57.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.058 -0.519 . . . . 61.109999999999999 111.16 -177.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? . . . . . 0 C--N 1.32 -0.688 0 CA-C-N 115.935 -0.575 . . . . 73.439999999999998 110.008 177.578 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 120.979 0.418 . . . . 74.409999999999997 110.34 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -119.74 42.47 1.75 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.444 -0.884 . . . . 60.530000000000001 112.107 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.0 m -140.19 91.17 2.43 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.068 0.461 . . . . 62.25 109.81 178.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 m -129.04 93.63 3.64 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.825 -0.625 . . . . 73.310000000000002 110.607 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -133.56 88.36 2.47 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.128 -0.487 . . . . 71.129999999999995 111.09 176.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -113.59 118.47 34.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.759 -0.655 . . . . 71.439999999999998 109.477 173.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -158.77 113.16 2.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.258 -0.428 . . . . 75.319999999999993 110.201 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -141.52 127.05 18.9 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.778 -0.647 . . . . 71.150000000000006 109.847 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -170.74 82.79 0.09 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.208 -0.451 . . . . 62.219999999999999 110.036 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -150.87 93.2 1.91 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.394 -0.366 . . . . 60.229999999999997 111.029 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.2 m -156.59 94.65 1.49 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.974 -0.557 . . . . 74.549999999999997 109.593 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.0 m -148.0 126.8 12.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.809 0.299 . . . . 54.219999999999999 111.809 -177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 92.69 130.4 5.31 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.119 -0.562 . . . . 55.32 114.189 170.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.72 157.27 37.8 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.231 -0.655 . . . . 74.150000000000006 109.231 170.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 C--N 1.321 -0.633 0 CA-C-O 121.072 0.463 . . . . 70.340000000000003 111.386 179.73 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mp . . . . . 0 C--O 1.23 0.071 0 N-CA-C 109.83 -0.433 . . . . 72.340000000000003 109.83 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -115.71 148.74 39.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.622 0.249 . . . . 65.239999999999995 111.263 -176.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.933 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.8 tt0 -84.13 121.4 27.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.957 -0.565 . . . . 62.420000000000002 110.51 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.436 ' CD1' HG22 ' A' ' 72' ' ' VAL . 9.8 mp -100.6 -66.21 0.92 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.803 0.668 . . . . 75.239999999999995 112.803 -173.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.619 ' CB ' ' HA ' ' A' ' 93' ' ' LEU . 2.4 pt? -142.25 169.22 18.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.18 0.514 . . . . 73.019999999999996 111.934 -171.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -100.87 136.19 41.11 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.089 -0.96 . . . . 73.010000000000005 109.443 176.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.8 p -117.74 92.32 3.81 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.539 0.685 . . . . 70.430000000000007 111.172 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.538 ' H ' HD22 ' A' ' 30' ' ' ASN . 0.1 OUTLIER -111.54 9.53 21.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.817 0.818 . . . . 74.0 109.352 175.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.482 ' HB3' ' HB3' ' A' ' 34' ' ' LEU . 18.1 t70 -114.03 125.53 54.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.83 -1.077 . . . . 53.329999999999998 109.799 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.24 -44.02 97.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.19 -0.459 . . . . 73.439999999999998 111.602 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 46.9 t -70.76 -44.58 76.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.309 -0.405 . . . . 54.409999999999997 110.668 -176.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.602 HD22 ' HG3' ' A' ' 92' ' ' GLU . 29.2 tp -58.65 -42.74 89.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.969 -0.56 . . . . 71.209999999999994 111.204 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 64.8 tp -62.49 -35.79 80.48 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.176 -0.465 . . . . 62.439999999999998 110.875 -177.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.2 m -70.55 -42.38 71.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 54.240000000000002 110.648 176.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.72 -54.1 31.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 55.210000000000001 111.537 -177.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.491 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 87.1 t -62.7 -41.07 90.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.997 0.427 . . . . 64.340000000000003 110.662 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.36 -34.33 89.62 Favored Glycine 0 N--CA 1.453 -0.196 0 CA-C-N 115.784 -0.644 . . . . 64.420000000000002 112.489 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.57 -36.28 68.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 55.520000000000003 110.779 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 87.2 mt -65.74 -46.3 79.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.996 -0.547 . . . . 65.430000000000007 110.501 178.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 38' ' ' VAL . 85.7 mt -59.02 -47.77 84.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.577 -0.738 . . . . 64.349999999999994 110.559 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -68.56 -37.51 79.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.131 -0.486 . . . . 73.230000000000004 110.856 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.1 -20.76 67.36 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 115.788 -0.642 . . . . 50.130000000000003 113.182 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -109.68 7.97 24.6 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.802 -0.234 . . . . 75.430000000000007 111.218 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.7 t70 61.07 33.99 19.33 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.748 0.785 . . . . 72.239999999999995 110.665 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.928 HG23 ' HB3' ' A' ' 76' ' ' ASP . 84.8 mt -82.41 120.25 33.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.521 -0.763 . . . . 62.030000000000001 110.321 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.68 109.45 2.91 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.927 -0.654 . . . . 71.420000000000002 111.747 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -126.39 148.14 49.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.976 0.417 . . . . 72.310000000000002 111.065 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 65.5 tp -127.99 127.98 44.2 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.774 -0.648 . . . . 65.219999999999999 109.579 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.3 m . . . . . 0 C--N 1.318 -0.769 0 CA-C-O 120.989 0.423 . . . . 74.219999999999999 110.948 179.84 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo . . . . . 0 N--CA 1.461 -0.385 0 CA-C-O 120.465 0.111 . . . . 44.020000000000003 111.813 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 -58.96 136.89 58.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.505 -0.554 . . . . 72.219999999999999 109.505 175.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.403 ' HD3' ' OE2' ' A' ' 25' ' ' GLU . 74.3 mtt180 -113.35 139.45 48.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.853 0.358 . . . . 74.420000000000002 110.905 -175.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.4 t -105.38 118.49 52.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.02 -0.536 . . . . 62.119999999999997 110.68 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.933 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.9 mp -114.96 150.23 36.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.843 -0.617 . . . . 65.049999999999997 109.771 177.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.809 HG23 HD22 ' A' ' 77' ' ' LEU . 34.4 m -130.56 163.3 36.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.295 0.569 . . . . 72.019999999999996 111.233 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.44 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 41.2 t-80 -75.87 150.89 37.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.274 -0.875 . . . . 63.229999999999997 110.841 -176.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 24.4 mm-40 -38.74 -64.72 0.42 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.148 1.166 . . . . 73.030000000000001 114.148 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -67.38 -19.09 65.36 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.442 0.639 . . . . 65.030000000000001 110.963 -174.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.928 ' HB3' HG23 ' A' ' 47' ' ' ILE . 2.4 m-20 -85.73 -14.06 46.47 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.343 -0.844 . . . . 71.420000000000002 110.613 -176.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.809 HD22 HG23 ' A' ' 72' ' ' VAL . 1.6 mm? -52.72 -57.94 8.47 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.095 -0.502 . . . . 74.099999999999994 111.409 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.56 -42.88 83.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.996 -0.547 . . . . 55.140000000000001 111.056 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.42 -48.11 77.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.813 -0.708 . . . . 21.43 112.555 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.498 ' HB2' HG21 ' A' ' 47' ' ' ILE . . . -65.47 -47.31 76.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.648 0.261 . . . . 75.230000000000004 111.417 -178.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.539 ' HD2' HD12 ' A' ' 77' ' ' LEU . 39.3 mtp180 -64.44 -38.83 92.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.402 -0.363 . . . . 72.310000000000002 110.582 -177.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 82' ' ' ARG . 40.9 ttt-85 -66.42 -44.33 83.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.116 0.484 . . . . 64.200000000000003 110.389 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.4 tp -62.31 -47.52 83.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.586 -0.733 . . . . 73.519999999999996 111.283 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.87 -28.72 70.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 63.299999999999997 110.962 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.9 m -74.46 -39.15 62.7 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.827 0.346 . . . . 55.439999999999998 110.505 177.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -66.49 -37.02 84.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.024 0.44 . . . . 73.340000000000003 110.688 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.26 -17.27 52.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.971 -0.559 . . . . 74.310000000000002 111.172 178.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 78.16 28.54 55.92 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.863 -0.608 . . . . 73.200000000000003 112.796 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.8 mt -103.56 5.09 36.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.977 0.418 . . . . 74.019999999999996 110.639 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.819 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -76.22 73.03 3.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.297 0.57 . . . . 64.310000000000002 110.681 178.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -129.31 -34.24 1.86 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.759 -0.655 . . . . 63.140000000000001 110.407 179.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.602 ' HG3' HD22 ' A' ' 34' ' ' LEU . 51.7 mm-40 -98.18 8.7 44.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.582 -0.735 . . . . 75.019999999999996 111.011 -175.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.819 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.8 mp -80.99 121.34 25.92 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.822 -0.436 . . . . 65.400000000000006 109.822 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 . . . . . 0 N--CA 1.452 -0.343 0 CA-C-O 121.51 0.671 . . . . 65.019999999999996 110.327 -177.997 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.4 ttp . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.802 0.335 . . . . 74.140000000000001 110.247 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.12 60.14 0.92 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.518 -0.849 . . . . 61.119999999999997 112.505 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 10.7 m -77.78 99.77 6.02 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.465 -0.568 . . . . 64.129999999999995 109.465 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.9 t -129.9 101.34 5.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.459 -0.337 . . . . 51.229999999999997 110.942 -174.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -82.76 132.3 35.18 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.624 -0.51 . . . . 64.420000000000002 109.624 176.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -98.9 122.82 42.65 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.253 0.549 . . . . 72.420000000000002 111.565 -173.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.0 p-80 -133.23 115.44 14.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.374 -0.83 . . . . 75.510000000000005 109.171 175.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 18.8 t-80 -138.28 -15.9 1.25 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.284 -0.416 . . . . 72.430000000000007 110.737 -176.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -76.61 77.07 3.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.184 0.516 . . . . 72.239999999999995 110.314 177.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -93.5 -33.6 13.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.62 -0.718 . . . . 74.439999999999998 109.646 178.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -82.65 114.1 20.79 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.516 -0.766 . . . . 64.019999999999996 110.066 177.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.0 t -140.22 107.65 5.56 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.991 -0.549 . . . . 70.099999999999994 110.482 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 107.2 146.99 13.41 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 111.325 -0.71 . . . . 53.140000000000001 111.325 -176.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.5 ptp85 -143.18 -14.65 0.69 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.141 0.47 . . . . 65.140000000000001 111.931 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 C--N 1.328 -0.366 0 CA-C-O 121.801 0.81 . . . . 75.400000000000006 110.803 -177.543 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.0 mp . . . . . 0 N--CA 1.47 0.526 0 CA-C-O 121.728 0.775 . . . . 64.200000000000003 112.479 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -117.17 155.24 29.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.018 -0.992 . . . . 71.150000000000006 109.442 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.875 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 37.5 tt0 -85.09 121.87 28.49 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.844 -0.799 . . . . 75.219999999999999 108.844 171.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 93' ' ' LEU . 10.9 mp -87.42 -66.53 0.9 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.359 -0.382 . . . . 74.329999999999998 111.433 -176.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.542 HD21 HG11 ' A' ' 38' ' ' VAL . 4.0 pp -143.02 160.83 39.63 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.718 -0.393 . . . . 61.520000000000003 111.041 -175.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -144.07 129.18 18.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.513 -0.767 . . . . 74.299999999999997 109.385 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.401 HG21 HD23 ' A' ' 34' ' ' LEU . 11.2 t -151.49 163.46 38.96 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.964 0.411 . . . . 72.439999999999998 110.814 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -110.69 0.59 17.51 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.803 -0.635 . . . . 64.040000000000006 110.758 -177.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -94.43 123.55 37.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.892 0.377 . . . . 75.109999999999999 110.768 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.26 -27.77 63.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 61.200000000000003 111.75 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.28 -50.53 72.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.954 0.407 . . . . 71.319999999999993 110.284 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.401 HD23 HG21 ' A' ' 29' ' ' THR . 55.7 tp -62.4 -40.19 95.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.067 -0.515 . . . . 70.109999999999999 110.47 176.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.509 HD22 ' HD2' ' A' ' 68' ' ' ARG . 76.7 mt -62.15 -31.28 71.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.859 -0.61 . . . . 73.409999999999997 111.351 177.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.0 m -75.6 -44.84 40.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.792 0.33 . . . . 75.219999999999999 110.501 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.482 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -59.94 -50.5 73.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 64.340000000000003 111.055 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.542 HG11 HD21 ' A' ' 27' ' ' LEU . 95.8 t -69.84 -41.93 79.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-O 121.104 0.478 . . . . 65.019999999999996 110.448 178.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.62 -49.13 81.83 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.742 -0.663 . . . . 53.340000000000003 112.793 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.43 -26.41 67.85 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.704 0.261 . . . . 65.549999999999997 111.704 -177.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.561 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.6 mt -69.9 -52.25 26.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.018 0.437 . . . . 73.019999999999996 110.616 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.3 mt -74.5 -39.58 62.35 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.015 -0.538 . . . . 74.540000000000006 111.067 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -68.61 -42.4 78.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.998 -0.546 . . . . 74.129999999999995 110.794 -177.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.96 -29.31 67.18 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 121.12 -0.562 . . . . 51.530000000000001 112.737 -177.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -85.74 -0.75 56.08 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.68 -0.306 . . . . 74.510000000000005 111.184 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.7 t70 66.82 21.23 10.51 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.611 0.72 . . . . 74.349999999999994 110.941 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 63.6 mt -75.84 142.83 13.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.699 -0.682 . . . . 70.129999999999995 109.528 177.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.52 113.44 4.91 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.963 -0.637 . . . . 61.329999999999998 111.832 177.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 33.6 p-80 -128.3 99.3 5.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.328 0.585 . . . . 60.409999999999997 111.532 -173.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.6 tp -83.21 89.0 6.91 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.839 -0.619 . . . . 70.540000000000006 109.373 176.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.658 HG12 HG22 ' A' ' 70' ' ' VAL . 14.9 m . . . . . 0 C--N 1.323 -0.587 0 CA-C-N 115.592 -0.731 . . . . 65.239999999999995 110.502 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo . . . . . 0 N--CA 1.445 -1.378 0 CA-C-O 120.71 0.212 . . . . 60.340000000000003 112.143 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.509 ' HD2' HD22 ' A' ' 35' ' ' LEU . 42.2 ttm180 -74.01 132.66 42.6 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.391 -0.596 . . . . 74.140000000000001 109.391 177.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -113.02 134.49 54.49 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.883 -0.599 . . . . 75.019999999999996 109.514 -174.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.658 HG22 HG12 ' A' ' 51' ' ' VAL . 42.5 t -112.85 118.63 58.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.097 -0.501 . . . . 71.420000000000002 110.8 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.875 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.1 mp -122.71 143.03 50.07 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.136 -0.484 . . . . 74.25 110.058 177.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.51 HG23 HD22 ' A' ' 77' ' ' LEU . 33.0 m -133.56 169.91 20.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.728 -0.215 . . . . 51.420000000000002 110.59 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -74.01 142.19 45.78 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.184 -0.673 . . . . 74.200000000000003 109.184 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.734 ' HA ' HD23 ' A' ' 77' ' ' LEU . 40.3 mt-10 -73.57 -8.46 56.06 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.198 0.814 . . . . 61.240000000000002 113.198 -171.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -86.31 -23.69 26.17 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.204 0.526 . . . . 73.420000000000002 109.77 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -101.18 8.65 42.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.745 -0.661 . . . . 61.039999999999999 110.132 172.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.734 HD23 ' HA ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -59.05 -55.39 35.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.823 -0.626 . . . . 72.439999999999998 110.115 -178.291 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.38 -36.32 71.11 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.129 -0.487 . . . . 64.409999999999997 111.12 177.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.37 -49.14 72.67 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.982 -0.628 . . . . 74.530000000000001 112.007 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.05 -42.94 93.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.502 0.192 . . . . 75.040000000000006 111.108 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.657 ' HD2' HD12 ' A' ' 77' ' ' LEU . 74.8 mtp180 -58.64 -47.25 85.05 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.507 -0.315 . . . . 74.140000000000001 110.412 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -58.72 -47.26 85.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 75.340000000000003 110.304 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.561 HD21 ' HB3' ' A' ' 41' ' ' LEU . 46.8 tp -60.94 -49.61 76.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.729 -0.669 . . . . 75.209999999999994 111.101 -178.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.526 HD21 HG13 ' A' ' 38' ' ' VAL . 84.5 mt -64.93 -36.77 85.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.471 -0.331 . . . . 75.109999999999999 111.351 -178.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 33.2 m -70.99 -41.76 70.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.899 0.38 . . . . 72.310000000000002 110.404 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -65.98 -34.51 78.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.939 -0.573 . . . . 64.540000000000006 110.694 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.54 -34.29 60.73 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.932 -0.576 . . . . 70.319999999999993 111.195 177.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 98.96 28.64 7.66 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.807 -0.711 . . . . 75.049999999999997 111.916 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 97.4 mt -113.79 -1.9 13.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.154 0.502 . . . . 72.420000000000002 110.897 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.569 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -75.0 93.61 2.74 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.547 . . . . 54.340000000000003 110.024 177.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -155.13 -44.71 0.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.96 -0.564 . . . . 75.120000000000005 110.346 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -84.27 10.6 10.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.097 -0.501 . . . . 65.5 111.209 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.569 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.3 mp -77.79 101.08 6.55 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.191 -0.459 . . . . 64.200000000000003 109.764 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.445 ' HD2' ' HA ' ' A' ' 94' ' ' ARG . 15.2 tpt180 . . . . . 0 C--N 1.322 -0.614 0 CA-C-N 116.245 -0.434 . . . . 74.209999999999994 110.494 -175.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.9 tpt . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.637 0.256 . . . . 74.239999999999995 110.711 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.2 -6.56 0.15 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.018 -1.087 . . . . 74.450000000000003 113.177 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.1 p -76.39 100.42 5.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.194 0.521 . . . . 63.219999999999999 110.867 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.6 m -152.01 -171.17 3.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.921 -0.581 . . . . 74.540000000000006 109.682 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.6 t60 75.06 -36.0 0.3 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.077 0.551 . . . . 72.340000000000003 111.756 177.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -77.12 86.62 3.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.447 0.641 . . . . 75.540000000000006 109.887 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -135.96 121.95 20.07 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.495 -0.775 . . . . 73.230000000000004 109.202 -177.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -152.29 155.09 37.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.752 -0.203 . . . . 73.129999999999995 110.869 -177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -159.92 106.5 1.62 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.966 0.413 . . . . 73.409999999999997 110.292 176.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.7 t-80 -139.34 80.85 1.8 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.884 -0.598 . . . . 73.319999999999993 109.988 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.7 p -98.68 91.36 5.08 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.006 -0.543 . . . . 62.229999999999997 110.687 -178.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.1 p -132.58 110.89 10.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.046 -0.525 . . . . 63.240000000000002 111.095 -177.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 135.15 131.65 3.08 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.476 -0.869 . . . . 61.009999999999998 112.354 178.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -118.49 -37.38 3.32 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.8 0.333 . . . . 74.129999999999995 110.525 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 121.4 0.619 . . . . 64.230000000000004 110.682 -179.612 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.612 HD22 ' HB2' ' A' ' 50' ' ' LEU . 8.6 mp . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 121.144 0.497 . . . . 72.109999999999999 111.515 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 50.7 mtm180 -110.35 145.39 37.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.288 -0.415 . . . . 70.420000000000002 111.348 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.528 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 32.1 tt0 -70.88 110.96 5.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.651 -0.704 . . . . 70.040000000000006 109.877 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.477 HD22 HG21 ' A' ' 72' ' ' VAL . 57.0 tp -98.85 -38.23 9.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.211 -0.45 . . . . 50.240000000000002 111.348 -174.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.592 ' HG ' ' HB ' ' A' ' 70' ' ' VAL . 1.0 OUTLIER -142.55 148.8 38.16 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.259 0.552 . . . . 74.400000000000006 110.805 179.362 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 28' ' ' ARG . 22.5 ttt180 -138.63 104.61 5.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.334 -0.848 . . . . 71.319999999999993 109.113 -174.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.7 t -121.14 175.84 5.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.43 0.633 . . . . 63.32 112.052 -170.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -130.34 17.54 5.43 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.019 -0.991 . . . . 72.230000000000004 110.58 -175.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -128.34 126.58 41.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 72.310000000000002 111.25 -177.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.674 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -76.95 -26.39 53.95 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.067 -0.515 . . . . 71.299999999999997 111.678 -177.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.9 t -68.71 -45.9 80.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.077 0.465 . . . . 70.340000000000003 109.842 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.15 -38.86 90.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.857 -0.611 . . . . 73.219999999999999 110.303 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.674 HD12 ' HA ' ' A' ' 32' ' ' ALA . 69.1 mt -58.37 -37.7 75.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 74.209999999999994 111.281 176.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.3 m -64.99 -37.05 86.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 51.530000000000001 110.276 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.74 -54.15 8.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.999 -0.546 . . . . 65.409999999999997 111.08 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.574 HG11 HD11 ' A' ' 27' ' ' LEU . 99.5 t -60.58 -38.78 79.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.247 -0.433 . . . . 73.5 111.075 -178.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.66 -51.48 58.44 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.864 -0.607 . . . . 74.340000000000003 112.196 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.23 72.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.644 0.259 . . . . 32.439999999999998 111.355 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 84.1 mt -65.69 -52.14 53.83 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.937 0.399 . . . . 62.020000000000003 110.725 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.4 mt -70.53 -39.1 74.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.919 -0.582 . . . . 74.299999999999997 110.563 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.73 -36.74 81.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 71.010000000000005 110.403 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.85 -24.25 62.51 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 121.047 -0.596 . . . . 64.109999999999999 113.067 -179.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.61 6.82 42.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.927 0.364 . . . . 74.120000000000005 111.464 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.1 t70 67.42 21.2 9.75 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.479 0.657 . . . . 64.420000000000002 110.372 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.818 HG23 ' HB3' ' A' ' 76' ' ' ASP . 78.5 mt -83.14 128.48 38.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.053 -0.521 . . . . 75.129999999999995 110.268 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.32 113.48 5.87 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.104 -0.57 . . . . 71.400000000000006 112.056 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.56 137.54 52.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.117 0.484 . . . . 74.430000000000007 111.431 -177.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.853 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 5.9 tt -107.79 95.17 5.5 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.901 -0.778 . . . . 54.539999999999999 108.901 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.454 HG11 HG22 ' A' ' 70' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 115.582 -0.736 . . . . 64.25 110.176 178.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo . . . . . 0 N--CA 1.454 -0.795 0 N-CA-C 110.251 -0.711 . . . . 65.400000000000006 110.251 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.471 ' HA ' ' NE ' ' A' ' 68' ' ' ARG . 5.3 mmp_? -127.57 150.83 49.54 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.46 0.648 . . . . 75.530000000000001 111.417 -175.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.492 ' HD3' ' OE1' ' A' ' 25' ' ' GLU . 18.9 ptp180 -114.72 136.85 52.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.832 -1.076 . . . . 74.329999999999998 108.948 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.592 ' HB ' ' HG ' ' A' ' 27' ' ' LEU . 97.8 t -108.52 114.4 46.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 120.953 0.406 . . . . 71.109999999999999 110.272 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.853 ' HB2' ' HB3' ' A' ' 50' ' ' LEU . 8.5 mp -101.53 140.12 36.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.573 -0.74 . . . . 71.430000000000007 109.4 176.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.864 HG23 HD22 ' A' ' 77' ' ' LEU . 23.9 m -126.16 162.94 28.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.325 0.583 . . . . 71.319999999999993 111.13 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.463 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 2.5 t-160 -74.22 162.19 29.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.079 -0.964 . . . . 70.340000000000003 110.257 -175.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.588 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 26.0 mm-40 -58.09 -58.88 6.49 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.85 0.685 . . . . 71.329999999999998 112.85 -174.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -73.33 -25.31 60.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.557 0.694 . . . . 64.239999999999995 110.041 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.818 ' HB3' HG23 ' A' ' 47' ' ' ILE . 1.5 m-20 -74.24 -14.65 60.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.168 -0.923 . . . . 63.539999999999999 110.63 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.864 HD22 HG23 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -53.49 -57.79 9.44 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.01 0.524 . . . . 71.040000000000006 111.249 -177.338 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.8 -38.34 90.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.691 -0.686 . . . . 70.129999999999995 111.04 -178.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.52 -44.99 94.37 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.902 -0.666 . . . . 74.420000000000002 112.124 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.58 97.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.728 0.299 . . . . 74.319999999999993 110.714 179.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -60.88 -50.94 71.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.43 . . . . 63.32 110.59 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -57.67 -43.95 85.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 64.510000000000005 110.819 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.6 tp -59.84 -54.74 42.67 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.028 -0.533 . . . . 72.030000000000001 111.054 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.479 HD21 HG13 ' A' ' 38' ' ' VAL . 90.4 mt -63.18 -30.78 71.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.996 -0.547 . . . . 75.310000000000002 111.385 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 88.4 m -66.79 -43.0 85.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.573 0.225 . . . . 72.349999999999994 110.812 178.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -69.09 -34.11 74.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.978 0.418 . . . . 60.509999999999998 110.582 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.95 -4.26 54.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.904 -0.589 . . . . 73.109999999999999 111.673 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 72.32 21.67 79.24 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.99 -0.624 . . . . 72.030000000000001 112.785 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.0 mt -105.47 10.26 33.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.08 0.467 . . . . 73.209999999999994 110.829 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.724 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -73.78 77.09 1.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.45 -0.574 . . . . 61.530000000000001 109.45 174.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -131.56 -51.22 0.99 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.332 -0.849 . . . . 71.329999999999998 110.421 -172.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -91.74 8.83 35.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.598 -0.728 . . . . 75.420000000000002 110.974 -176.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.724 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.3 mp -73.47 134.37 43.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.168 -0.469 . . . . 73.5 110.319 -178.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 53.3 mtt180 . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.064 -0.516 . . . . 72.109999999999999 110.8 -177.263 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 110.045 -0.354 . . . . 61.149999999999999 110.045 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 102.24 126.66 5.9 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.599 -0.81 . . . . 61.43 112.951 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.4 t -130.94 125.47 33.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.648 -0.871 . . . . 70.219999999999999 108.648 173.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.3 m -139.78 117.96 11.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.112 0.482 . . . . 30.23 111.658 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -162.7 96.01 0.92 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.614 -0.721 . . . . 75.430000000000007 109.748 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -140.3 92.16 2.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.831 0.824 . . . . 52.030000000000001 111.194 178.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -131.68 85.75 2.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.743 -0.662 . . . . 74.430000000000007 109.825 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.3 t-80 -160.2 84.04 0.72 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.787 -0.642 . . . . 71.540000000000006 110.457 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -157.46 42.65 0.32 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.45 -0.574 . . . . 74.010000000000005 109.45 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 35.9 t-80 -83.98 86.92 7.12 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.975 -0.75 . . . . 74.010000000000005 108.975 176.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.6 m -155.07 102.66 2.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.695 -0.684 . . . . 63.109999999999999 109.92 -175.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -149.65 114.42 5.33 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.374 -0.376 . . . . 60.450000000000003 110.399 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -107.86 169.66 14.69 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.733 -0.746 . . . . 62.219999999999999 111.795 178.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -115.71 102.78 10.05 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.063 0.459 . . . . 71.439999999999998 110.792 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 . . . . . 0 C--N 1.325 -0.473 0 CA-C-O 121.035 0.445 . . . . 73.019999999999996 110.071 177.151 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 N--CA 1.463 0.219 0 CA-C-O 121.316 0.579 . . . . 74.049999999999997 110.027 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.498 ' HB2' HD23 ' A' ' 77' ' ' LEU . 87.7 mtt180 -107.11 147.78 29.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.082 -0.508 . . . . 73.409999999999997 110.189 -174.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.621 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 35.7 tt0 -72.83 136.67 45.41 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.529 -0.545 . . . . 63.420000000000002 109.529 177.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.639 HD12 HD22 ' A' ' 27' ' ' LEU . 1.4 tm? -97.75 -50.45 4.45 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.716 -0.476 . . . . 61.549999999999997 109.716 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.639 HD22 HD12 ' A' ' 26' ' ' LEU . 2.6 pt? -158.39 157.98 33.35 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.472 -0.331 . . . . 75.099999999999994 110.805 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.19 132.03 42.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.834 -0.621 . . . . 63.32 110.16 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.4 t -142.99 170.96 14.72 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.917 -0.401 . . . . 74.299999999999997 109.917 176.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.638 ' HA ' ' HA ' ' A' ' 67' ' ' PRO . 4.2 p-10 -116.67 9.63 14.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.347 0.594 . . . . 64.329999999999998 110.008 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -117.09 128.37 55.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.539 -0.755 . . . . 71.349999999999994 111.266 -175.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.703 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -77.54 -21.07 53.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.819 -0.628 . . . . 54.409999999999997 111.705 -176.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.7 t -69.18 -49.39 62.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.156 0.503 . . . . 65.040000000000006 109.849 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.5 tp -60.91 -37.51 82.52 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.641 -0.709 . . . . 63.340000000000003 110.231 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.703 HD12 ' HA ' ' A' ' 32' ' ' ALA . 78.5 mt -59.34 -35.15 73.32 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.98 -0.555 . . . . 61.299999999999997 111.072 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -69.74 -42.54 73.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.4 -0.364 . . . . 71.209999999999994 110.445 179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.498 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.77 -53.17 44.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 63.439999999999998 111.04 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.525 HG13 HD21 ' A' ' 84' ' ' LEU . 99.1 t -61.43 -40.57 86.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 121.127 0.489 . . . . 74.230000000000004 110.591 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.4 -48.48 85.97 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.685 -0.689 . . . . 73.209999999999994 111.979 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.63 -28.48 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 62.439999999999998 111.443 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 88.3 mt -67.13 -51.64 51.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.863 0.364 . . . . 72.049999999999997 110.559 177.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 82.5 mt -72.43 -39.11 68.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.98 -0.555 . . . . 75.120000000000005 110.665 -177.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -66.92 -41.2 87.45 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.463 -0.79 . . . . 73.230000000000004 110.666 -178.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -80.08 -11.79 84.03 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.622 -0.799 . . . . 62.549999999999997 112.83 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -102.85 4.22 37.5 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.711 -0.288 . . . . 61.240000000000002 111.225 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.4 t70 63.15 32.48 15.11 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.682 0.753 . . . . 71.530000000000001 110.575 178.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 68.6 mt -93.58 130.09 43.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.884 -0.598 . . . . 63.119999999999997 110.308 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.18 117.96 6.59 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.929 -0.578 . . . . 62.32 112.165 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 54.0 p-80 -139.53 142.53 37.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.078 0.466 . . . . 44.340000000000003 110.935 -175.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 tp -113.31 115.82 28.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.971 -0.558 . . . . 73.230000000000004 110.824 -176.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.7 m . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.582 -0.736 . . . . 73.420000000000002 109.753 173.792 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.638 ' HA ' ' HA ' ' A' ' 30' ' ' ASN . 10.4 Cg_exo . . . . . 0 N--CA 1.46 -0.481 0 CA-C-O 121.005 0.335 . . . . 74.5 111.231 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.636 ' HB3' HD11 ' A' ' 35' ' ' LEU . 12.7 tpp180 -93.99 135.47 35.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.513 0.673 . . . . 75.310000000000002 110.952 -175.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.478 ' HD2' ' OE1' ' A' ' 25' ' ' GLU . 18.1 ptt180 -119.01 145.97 45.42 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.414 -0.812 . . . . 62.210000000000001 110.122 178.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.2 t -105.18 123.3 59.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.859 -0.609 . . . . 61.229999999999997 110.101 -177.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.621 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 9.6 mp -103.88 155.34 18.7 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.402 -0.592 . . . . 75.140000000000001 109.402 175.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.4 m -137.82 168.49 20.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.773 0.32 . . . . 62.130000000000003 110.399 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.424 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 27.6 m80 -73.42 160.51 31.65 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.95 -0.759 . . . . 73.519999999999996 108.95 176.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.32 -11.07 60.54 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.983 0.421 . . . . 72.409999999999997 110.849 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -91.71 -23.18 19.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.031 -0.532 . . . . 75.310000000000002 110.729 174.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.424 ' OD1' ' HB2' ' A' ' 73' ' ' HIS . 9.8 m-20 -93.76 -13.31 27.54 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.873 -0.603 . . . . 73.319999999999993 110.213 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.498 HD23 ' HB2' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -52.74 -57.08 11.29 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.639 -0.71 . . . . 74.420000000000002 111.183 -176.462 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.85 97.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.383 -0.371 . . . . 71.109999999999999 111.322 -177.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.8 -46.67 81.41 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.816 -0.706 . . . . 71.120000000000005 112.446 -177.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.51 -41.21 96.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.653 0.263 . . . . 73.310000000000002 111.413 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -60.47 -53.02 62.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.338 -0.392 . . . . 73.439999999999998 111.241 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -64.34 -32.62 74.3 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.704 0.261 . . . . 63.100000000000001 111.704 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.59 -54.65 32.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.783 0.325 . . . . 71.200000000000003 110.707 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.525 HD21 HG13 ' A' ' 38' ' ' VAL . 11.3 mp -65.46 -31.71 72.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 73.540000000000006 111.442 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.727 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 85.7 m -64.31 -46.28 84.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.739 0.304 . . . . 44.399999999999999 110.782 178.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.73 -29.79 69.11 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.036 0.446 . . . . 71.019999999999996 110.457 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.3 -14.79 60.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.183 -0.462 . . . . 74.230000000000004 111.131 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.64 9.57 66.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.798 -0.715 . . . . 73.099999999999994 112.415 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 79.9 mt -96.88 14.29 25.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.917 0.389 . . . . 71.549999999999997 110.727 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.788 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -71.57 80.6 0.81 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.035 -0.529 . . . . 52.119999999999997 110.668 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -134.96 -58.12 0.81 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.939 -0.573 . . . . 64.329999999999998 109.883 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' A' ' 94' ' ' ARG . 77.0 mm-40 -90.67 7.84 37.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.221 -0.445 . . . . 74.299999999999997 111.751 -178.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.788 HD13 ' HA ' ' A' ' 90' ' ' ALA . 10.8 mp -61.29 118.94 7.55 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.811 -0.44 . . . . 71.129999999999995 109.811 176.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.535 ' HG3' ' O ' ' A' ' 92' ' ' GLU . 58.0 mtt180 . . . . . 0 C--N 1.322 -0.596 0 CA-C-O 121.566 0.698 . . . . 75.329999999999998 112.417 -172.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.479 1.024 0 CA-C-O 120.883 0.373 . . . . 64.310000000000002 110.416 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.02 130.16 5.36 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.868 -0.682 . . . . 63.310000000000002 111.879 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.0 p -121.69 -171.81 2.3 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.937 -0.394 . . . . 73.319999999999993 109.937 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.7 t -143.02 130.81 21.48 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.877 -0.416 . . . . 60.439999999999998 109.877 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -75.86 140.29 42.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.274 -0.421 . . . . 74.120000000000005 110.058 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -88.34 124.01 33.49 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.922 0.392 . . . . 73.329999999999998 111.275 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -146.55 166.3 26.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 74.129999999999995 110.355 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.1 p-80 -170.45 152.59 4.02 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.372 -0.603 . . . . 71.340000000000003 109.372 175.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -151.09 126.7 10.17 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.205 0.526 . . . . 73.019999999999996 111.801 -178.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -135.02 136.39 42.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.677 -0.692 . . . . 73.439999999999998 109.538 172.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.8 m -126.9 107.21 9.89 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.848 0.356 . . . . 73.230000000000004 110.579 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.0 m -110.66 112.3 24.09 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.153 -0.476 . . . . 73.299999999999997 110.531 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 155.63 142.43 3.43 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.506 -0.854 . . . . 74.510000000000005 112.816 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 14' ' ' ARG . 37.3 ttm180 -129.53 134.33 47.71 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.661 -0.496 . . . . 75.120000000000005 109.661 175.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 . . . . . 0 C--N 1.324 -0.506 0 CA-C-O 121.048 0.451 . . . . 75.430000000000007 110.922 -179.768 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.623 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . 6.0 mp . . . . . 0 C--O 1.231 0.125 0 N-CA-C 109.709 -0.478 . . . . 75.019999999999996 109.709 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.415 ' HG2' ' HG2' ' A' ' 74' ' ' GLU . 22.9 mmt180 -123.98 155.03 38.96 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.889 -0.411 . . . . 71.030000000000001 109.889 -178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -62.67 111.29 2.02 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 121.201 0.524 . . . . 73.099999999999994 110.813 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.6 tp -80.99 -23.03 39.01 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.166 -0.925 . . . . 72.109999999999999 108.809 175.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.506 ' HA ' ' HA ' ' A' ' 94' ' ' ARG . 0.7 OUTLIER 179.18 162.17 0.8 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.011 -0.995 . . . . 64.010000000000005 109.524 176.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -149.19 147.53 28.54 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.467 -0.568 . . . . 72.129999999999995 109.467 -179.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.411 HG22 HD21 ' A' ' 35' ' ' LEU . 13.4 t -170.1 169.36 7.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.979 0.419 . . . . 61.399999999999999 110.56 178.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -97.08 -8.8 29.38 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.909 -0.587 . . . . 74.450000000000003 110.678 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -82.28 148.54 28.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.375 -0.375 . . . . 74.329999999999998 110.625 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.63 -9.8 14.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.52 -0.309 . . . . 60.329999999999998 111.514 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.1 t -79.05 -43.53 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.289 0.566 . . . . 74.420000000000002 111.012 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.606 HD21 HD13 ' A' ' 89' ' ' LEU . 39.5 tp -70.1 -41.05 74.52 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.805 -0.634 . . . . 50.140000000000001 110.741 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.453 ' CD1' ' HB3' ' A' ' 68' ' ' ARG . 68.2 mt -64.87 -36.2 83.57 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.126 0.417 . . . . 73.329999999999998 112.126 -174.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.0 p -66.76 -29.7 69.73 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.99 0.424 . . . . 63.439999999999998 110.575 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.4 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.38 -42.95 61.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.452 . . . . 74.349999999999994 110.108 176.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 34' ' ' LEU . 61.6 t -57.3 -41.97 79.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.716 -0.675 . . . . 74.329999999999998 110.408 176.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -56.61 -50.59 62.12 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.41 -0.814 . . . . 74.430000000000007 112.305 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.94 -34.29 71.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.74 0.305 . . . . 73.0 111.406 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 83.5 mt -67.19 -46.46 73.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.111 0.482 . . . . 72.439999999999998 110.174 178.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.9 mt -69.12 -31.69 70.55 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.879 -0.601 . . . . 72.209999999999994 111.162 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -71.07 -38.72 72.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.266 -0.425 . . . . 61.009999999999998 110.081 175.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.01 -43.01 94.37 Favored Glycine 0 C--N 1.332 0.338 0 CA-C-N 115.956 -0.566 . . . . 50.329999999999998 112.452 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.4 -10.18 59.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.874 0.369 . . . . 72.409999999999997 110.66 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t70 61.92 34.65 16.75 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.386 -0.824 . . . . 73.340000000000003 110.906 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.2 mt -85.13 -29.35 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.724 0.773 . . . . 55.43 109.568 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.6 169.65 37.17 Favored Glycine 0 N--CA 1.447 -0.613 0 CA-C-N 114.987 -1.006 . . . . 44.100000000000001 111.595 -177.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -160.93 137.78 8.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.961 0.41 . . . . 52.25 111.954 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 2.8 tm? -109.75 103.25 12.05 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 107.755 -1.202 . . . . 51.520000000000003 107.755 168.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.597 HG12 HG22 ' A' ' 70' ' ' VAL . 3.1 m . . . . . 0 C--N 1.323 -0.551 0 CA-C-O 121.516 0.674 . . . . 63.25 111.493 -174.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo . . . . . 0 N--CA 1.447 -1.23 0 CA-C-O 121.012 0.338 . . . . 71.099999999999994 111.536 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.453 ' HB3' ' CD1' ' A' ' 35' ' ' LEU . 55.8 ttm-85 -89.32 136.31 33.09 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.908 -0.404 . . . . 73.239999999999995 109.908 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.99 141.94 46.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.239 -0.437 . . . . 51.439999999999998 110.362 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.597 HG22 HG12 ' A' ' 51' ' ' VAL . 48.1 t -102.38 106.94 20.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.663 -0.699 . . . . 74.510000000000005 109.838 177.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.623 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 10.3 mp -106.12 132.86 51.69 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.901 0.382 . . . . 62.350000000000001 111.103 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.3 m -120.77 155.25 24.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.307 -0.627 . . . . 65.030000000000001 109.307 173.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.434 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 7.5 t-80 -64.37 144.79 56.91 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.893 -0.41 . . . . 61.100000000000001 109.893 -178.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.528 ' HA ' HD23 ' A' ' 77' ' ' LEU . 42.6 mt-10 -71.6 69.23 0.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.299 0.571 . . . . 72.25 111.864 -176.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -141.98 -51.53 0.41 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.2 -0.909 . . . . 70.019999999999996 109.477 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -108.88 43.73 1.22 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.425 -0.807 . . . . 74.25 111.733 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 74' ' ' GLU . 4.1 mm? -65.18 -52.89 52.13 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.712 -0.477 . . . . 61.009999999999998 109.712 175.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.9 -22.64 62.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.203 -0.453 . . . . 73.239999999999995 110.942 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.24 -48.05 15.92 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 121.04 -0.6 . . . . 75.120000000000005 112.017 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.04 -38.62 86.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.776 0.322 . . . . 60.109999999999999 110.467 177.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.45 HH11 ' HD2' ' A' ' 81' ' ' ARG . 21.0 mtp180 -62.1 -28.23 69.47 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.119 -0.491 . . . . 71.450000000000003 110.406 175.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -69.8 -51.1 36.69 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.497 -0.557 . . . . 73.409999999999997 109.497 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.3 tp -60.01 -51.65 68.75 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.113 -0.949 . . . . 62.509999999999998 111.631 -177.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.0 mp -63.05 -27.58 69.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 73.329999999999998 111.844 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.889 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 70.1 m -81.45 -43.24 19.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.824 0.345 . . . . 73.340000000000003 111.08 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.69 -44.14 78.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 71.310000000000002 110.881 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.09 87.86 1.22 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.227 -0.442 . . . . 73.150000000000006 110.717 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -172.47 -69.43 0.04 OUTLIER Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.447 -0.883 . . . . 33.530000000000001 111.987 176.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.692 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -164.12 -56.65 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.637 0.256 . . . . 74.400000000000006 110.937 -175.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.889 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 60.6 13.37 4.19 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.72 -0.673 . . . . 71.340000000000003 112.168 -177.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -87.23 -40.99 14.04 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.131 -0.227 . . . . 72.140000000000001 110.992 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -93.5 -81.61 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.997 -0.281 . . . . 72.349999999999994 111.228 -177.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 96.1 mt 53.48 43.59 31.08 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.743 0.782 . . . . 71.310000000000002 109.521 -172.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.506 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 49.6 ttt180 . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 113.693 -1.594 . . . . 62.0 111.048 -173.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.736 0.303 . . . . 73.150000000000006 110.326 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.12 100.41 0.29 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.784 -0.722 . . . . 70.209999999999994 112.542 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.7 t -84.8 127.68 34.25 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.312 -0.625 . . . . 73.420000000000002 109.312 177.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.6 p -120.33 101.09 7.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.203 0.525 . . . . 54.439999999999998 111.061 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -158.81 118.91 3.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.702 -0.681 . . . . 44.119999999999997 110.617 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -149.98 115.86 5.62 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.537 -0.912 . . . . 62.439999999999998 108.537 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -93.41 106.21 18.2 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.389 -0.369 . . . . 70.239999999999995 110.689 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 24.1 p-80 -104.57 113.63 27.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.421 0.629 . . . . 70.409999999999997 110.936 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -149.37 108.03 3.83 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.592 -0.731 . . . . 73.519999999999996 109.918 174.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -160.72 125.9 3.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.135 -0.484 . . . . 63.140000000000001 110.515 -177.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.4 p -155.27 86.41 1.09 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.026 -0.533 . . . . 72.239999999999995 110.281 177.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.5 m -152.46 124.81 8.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.169 -0.469 . . . . 74.519999999999996 110.79 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 140.56 97.33 0.32 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.966 -0.635 . . . . 61.140000000000001 112.285 176.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.7 ttp180 -106.73 -41.1 5.32 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.496 -0.557 . . . . 71.040000000000006 109.496 177.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 . . . . . 0 C--O 1.236 0.39 0 CA-C-N 115.364 -0.835 . . . . 62.520000000000003 111.908 175.006 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.7 mp . . . . . 0 N--CA 1.468 0.468 0 CA-C-O 121.547 0.689 . . . . 75.219999999999999 111.783 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -125.36 166.04 17.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.459 -0.791 . . . . 71.519999999999996 109.162 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.803 ' HG2' ' HD2' ' A' ' 69' ' ' ARG . 2.0 mp0 -77.92 124.25 27.77 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.284 -0.635 . . . . 64.340000000000003 109.284 171.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.521 ' HB3' HD23 ' A' ' 27' ' ' LEU . 1.1 tm? -77.17 -30.73 55.03 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 108.801 -0.814 . . . . 74.5 108.801 177.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.521 HD23 ' HB3' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -170.08 160.53 8.17 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.563 -0.744 . . . . 73.230000000000004 110.84 -175.197 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.513 ' HD3' ' HB3' ' A' ' 67' ' ' PRO . 6.0 tmm_? -127.56 106.48 9.2 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 107.0 -1.481 . . . . 74.439999999999998 107.0 170.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.5 HG21 HD21 ' A' ' 35' ' ' LEU . 14.6 t -78.25 164.2 25.1 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.482 0.658 . . . . 72.230000000000004 111.573 -166.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -114.7 -3.5 12.84 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.159 -0.928 . . . . 55.5 110.397 178.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -131.93 147.2 52.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.504 -0.316 . . . . 44.450000000000003 110.995 -175.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -93.74 -23.35 18.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.346 -0.388 . . . . 63.229999999999997 111.532 -175.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.0 t -79.18 -37.78 19.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.319 0.58 . . . . 71.099999999999994 110.0 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.3 tp -57.03 -32.25 65.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.413 -0.812 . . . . 72.099999999999994 111.284 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.5 HD21 HG21 ' A' ' 29' ' ' THR . 93.5 mt -56.08 -39.6 72.34 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.944 0.402 . . . . 74.409999999999997 111.446 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.4 m -64.95 -26.85 68.48 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.886 -0.597 . . . . 51.409999999999997 110.895 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.21 -47.9 10.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.267 -0.424 . . . . 55.229999999999997 110.639 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.429 ' HA ' HD12 ' A' ' 41' ' ' LEU . 86.4 t -58.58 -40.54 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.163 -0.472 . . . . 73.310000000000002 111.416 -179.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.03 -50.03 72.09 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.025 -0.607 . . . . 73.099999999999994 112.553 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.41 -27.22 69.15 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.895 0.378 . . . . 71.209999999999994 111.295 -177.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.443 ' HB3' HD21 ' A' ' 83' ' ' LEU . 91.9 mt -69.82 -51.66 31.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.966 -0.561 . . . . 75.25 110.168 177.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.4 mt -65.44 -40.21 93.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.669 -0.696 . . . . 45.310000000000002 110.919 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -64.63 -47.56 78.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.993 0.425 . . . . 72.340000000000003 110.662 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.09 -25.75 75.18 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.984 -0.627 . . . . 44.340000000000003 113.058 -176.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.74 1.63 56.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.681 0.241 . . . . 51.240000000000002 111.46 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.2 t70 64.86 33.19 10.28 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 122.001 0.905 . . . . 71.25 110.287 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.803 HG23 ' HB3' ' A' ' 76' ' ' ASP . 71.5 mt -88.25 128.27 40.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.353 -0.839 . . . . 73.040000000000006 110.394 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.69 99.16 0.9 Allowed Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.812 -0.515 . . . . 44.109999999999999 111.812 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -122.7 152.52 40.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.778 0.323 . . . . 70.010000000000005 110.887 -173.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.0 tp -129.03 104.8 7.78 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.873 -0.603 . . . . 43.43 110.159 177.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.3 m . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 116.095 -0.502 . . . . 65.450000000000003 110.708 177.081 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.513 ' HB3' ' HD3' ' A' ' 28' ' ' ARG . 22.3 Cg_exo . . . . . 0 N--CA 1.463 -0.301 0 CA-C-O 121.052 0.355 . . . . 72.340000000000003 111.308 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.534 ' HA ' ' CZ ' ' A' ' 68' ' ' ARG . 0.7 OUTLIER -97.35 138.11 35.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.219 -0.446 . . . . 74.230000000000004 110.723 -177.305 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.803 ' HD2' ' HG2' ' A' ' 25' ' ' GLU . 81.9 mtm180 -113.55 133.54 55.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.994 -0.548 . . . . 71.109999999999999 109.865 178.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.2 t -103.62 114.93 44.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.518 -0.549 . . . . 73.310000000000002 109.518 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.481 HD11 ' HG3' ' A' ' 25' ' ' GLU . 10.1 mp -103.59 144.18 31.77 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.851 0.358 . . . . 72.200000000000003 111.143 -177.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.504 HG23 HD22 ' A' ' 77' ' ' LEU . 26.2 m -141.5 167.27 16.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.682 -0.69 . . . . 75.450000000000003 109.811 176.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.505 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 14.1 m-70 -74.8 162.87 28.28 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.21 -0.663 . . . . 74.340000000000003 109.21 176.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.514 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 17.5 mt-10 -71.17 -18.62 62.48 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.214 -0.662 . . . . 74.409999999999997 109.214 174.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -66.87 -37.79 85.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.266 -0.879 . . . . 72.230000000000004 109.624 172.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.803 ' HB3' HG23 ' A' ' 47' ' ' ILE . 8.5 m-20 -97.45 -4.86 37.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.057 -0.974 . . . . 61.310000000000002 110.505 -175.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.612 ' O ' ' HG3' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -53.24 -58.26 7.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.837 -0.62 . . . . 73.219999999999999 111.233 -172.1 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.84 -32.72 72.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.801 0.334 . . . . 54.109999999999999 111.232 -177.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.76 -47.17 91.17 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.81 -0.709 . . . . 62.43 112.055 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.58 -40.8 80.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.504 0.193 . . . . 55.210000000000001 110.837 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.612 ' HG3' ' O ' ' A' ' 77' ' ' LEU . 21.0 mtp180 -57.36 -53.88 53.13 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.416 -0.357 . . . . 74.439999999999998 110.969 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -67.24 -37.55 83.71 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.833 -0.347 . . . . 64.019999999999996 110.864 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.443 HD21 ' HB3' ' A' ' 41' ' ' LEU . 60.6 tp -58.89 -54.94 41.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.072 0.463 . . . . 64.310000000000002 110.773 179.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.9 mt -66.09 -27.62 68.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.794 -0.639 . . . . 71.340000000000003 111.724 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.75 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 69.0 m -79.37 -42.7 24.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.768 0.318 . . . . 42.43 111.0 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.96 -43.91 70.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.997 -0.547 . . . . 60.030000000000001 112.261 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.49 23.72 4.39 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.397 0.517 . . . . 43.210000000000001 112.397 -175.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -121.01 -84.01 0.76 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.03 -1.081 . . . . 73.5 111.517 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.524 HD12 ' N ' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -178.35 -31.84 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.48 -0.36 . . . . 70.120000000000005 111.514 -175.832 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.75 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 59.36 24.58 13.16 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.818 0.342 . . . . 72.510000000000005 111.686 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . 0.458 ' H ' ' CD1' ' A' ' 89' ' ' LEU . 45.0 t60 -89.98 -22.76 21.76 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.337 -0.392 . . . . 71.129999999999995 111.164 -175.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -92.69 -8.32 44.3 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.291 -0.413 . . . . 43.130000000000003 111.686 -173.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.692 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.5 mp -70.42 94.59 0.97 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.148 0.499 . . . . 73.040000000000006 110.696 -176.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 115.757 -0.656 . . . . 74.430000000000007 111.739 -174.686 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 mmt . . . . . 0 N--CA 1.482 1.139 0 CA-C-O 120.695 0.284 . . . . 52.329999999999998 110.263 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 118.91 112.81 2.49 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.882 -0.675 . . . . 71.049999999999997 112.128 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.7 t -128.96 95.74 4.16 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.981 0.42 . . . . 72.129999999999995 109.951 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.0 m -147.84 147.9 30.29 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.653 -0.703 . . . . 73.400000000000006 109.669 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -137.37 105.68 5.76 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.297 0.57 . . . . 73.409999999999997 110.698 178.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -102.62 119.59 39.09 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.781 -0.645 . . . . 74.519999999999996 109.868 177.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -71.9 87.84 1.02 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.21 -0.45 . . . . 70.400000000000006 110.064 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -75.99 150.3 37.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.065 -0.516 . . . . 73.319999999999993 110.851 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -171.2 101.83 0.21 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.127 -0.488 . . . . 71.409999999999997 110.182 176.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -100.03 152.55 20.08 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.184 -0.462 . . . . 65.120000000000005 110.034 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.2 p -84.87 164.63 18.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.348 -0.387 . . . . 75.129999999999995 110.792 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.3 m -114.22 121.18 42.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.918 0.39 . . . . 62.109999999999999 110.505 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -170.56 103.41 0.19 Allowed Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.294 -0.722 . . . . 44.109999999999999 111.294 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.8 ptt180 -119.17 141.64 48.67 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.933 0.397 . . . . 74.329999999999998 110.919 -176.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.636 0 CA-C-N 115.784 -0.644 . . . . 75.109999999999999 109.594 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 121.028 0.442 . . . . 51.329999999999998 110.508 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.7 ' HB3' HD23 ' A' ' 77' ' ' LEU . 0.6 OUTLIER -143.84 127.19 16.77 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.766 -0.457 . . . . 74.319999999999993 109.766 -178.63 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.728 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 24.8 tt0 -68.38 117.87 10.72 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.096 -0.502 . . . . 74.540000000000006 109.646 178.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.729 HD12 HD23 ' A' ' 27' ' ' LEU . 2.7 tm? -93.64 -61.18 1.6 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.233 -0.44 . . . . 74.219999999999999 111.292 -171.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.729 HD23 HD12 ' A' ' 26' ' ' LEU . 2.6 pp -142.25 161.7 37.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.779 0.323 . . . . 62.219999999999999 111.063 -173.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -134.94 135.87 41.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.686 -0.688 . . . . 70.329999999999998 110.038 178.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.4 t -144.61 176.41 9.43 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.019 0.438 . . . . 62.219999999999999 110.943 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -117.72 -11.31 10.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.982 -0.553 . . . . 75.329999999999998 110.103 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -102.61 153.96 19.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.753 -0.658 . . . . 72.140000000000001 110.768 -176.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -111.59 -11.28 14.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.252 -0.431 . . . . 54.240000000000002 111.239 -178.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.9 t -78.52 -43.93 26.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.918 0.39 . . . . 73.140000000000001 110.482 -178.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.663 HD21 HD13 ' A' ' 89' ' ' LEU . 66.1 tp -60.32 -31.6 70.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.891 -0.595 . . . . 73.120000000000005 110.797 177.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 77.6 mt -62.4 -22.64 66.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.583 -0.735 . . . . 70.400000000000006 111.754 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.3 m -60.83 -45.03 96.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.846 0.355 . . . . 53.140000000000001 110.362 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.518 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -68.06 -41.61 81.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.289 -0.414 . . . . 72.299999999999997 110.616 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 56.8 t -60.02 -45.35 95.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.94 -0.573 . . . . 73.230000000000004 110.27 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.44 -44.62 96.47 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.602 -0.726 . . . . 63.140000000000001 112.151 -179.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.36 -33.62 72.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.852 0.358 . . . . 51.509999999999998 110.986 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 91.2 mt -72.09 -47.77 48.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.13 -0.486 . . . . 62.140000000000001 110.7 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 91.4 mt -65.72 -47.42 75.39 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.113 -0.494 . . . . 60.43 110.809 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -42.27 98.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 74.319999999999993 110.836 178.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.32 -35.56 87.95 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.231 -0.509 . . . . 71.450000000000003 112.868 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.84 -0.01 55.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.619 0.247 . . . . 72.519999999999996 111.095 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.5 t70 61.38 35.76 17.74 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.999 0.904 . . . . 65.439999999999998 110.232 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.672 HG23 ' HB3' ' A' ' 76' ' ' ASP . 64.9 mt -88.8 119.73 36.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.156 -0.929 . . . . 74.030000000000001 110.57 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.82 137.0 46.98 Favored Glycine 0 C--N 1.332 0.307 0 N-CA-C 111.528 -0.629 . . . . 61.229999999999997 111.528 175.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 38.9 p-80 -152.56 138.57 18.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.114 0.483 . . . . 73.540000000000006 111.68 -171.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.0 tt -126.87 103.93 7.77 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.503 -0.771 . . . . 34.549999999999997 109.163 177.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 C--N 1.324 -0.508 0 N-CA-C 109.85 -0.426 . . . . 63.140000000000001 109.85 177.877 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo . . . . . 0 N--CA 1.463 -0.269 0 CA-C-O 120.859 0.275 . . . . 73.450000000000003 112.0 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 29.0 mmt-85 -101.84 113.33 26.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.192 -0.458 . . . . 75.519999999999996 109.838 -178.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -124.93 142.31 51.55 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.223 -0.591 . . . . 71.439999999999998 110.934 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.8 t -108.85 125.35 65.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.593 -0.73 . . . . 55.119999999999997 110.756 -174.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.728 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.0 mp -106.23 142.76 35.39 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.546 -0.538 . . . . 72.030000000000001 109.546 174.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.8 m -132.12 -178.41 2.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 109.847 -0.427 . . . . 55.149999999999999 109.847 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.587 ' HB2' ' HB2' ' A' ' 76' ' ' ASP . 24.9 m170 -68.49 158.12 34.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.817 0.341 . . . . 73.510000000000005 110.724 177.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -67.63 -38.78 84.39 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.221 -0.659 . . . . 73.030000000000001 109.221 174.482 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -73.4 -39.93 64.7 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.972 -1.013 . . . . 73.120000000000005 110.855 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.672 ' HB3' HG23 ' A' ' 47' ' ' ILE . 9.7 m-20 -78.34 -8.91 58.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.8 -0.636 . . . . 44.409999999999997 111.132 -178.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.757 HD12 ' HD3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -54.51 -46.2 73.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.041 0.448 . . . . 63.310000000000002 109.864 179.328 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.59 -36.64 79.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.506 -0.77 . . . . 63.119999999999997 111.357 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -78.49 -46.51 8.79 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.365 -0.921 . . . . 72.340000000000003 112.157 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.96 -47.9 73.08 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.911 0.337 . . . . 71.530000000000001 111.911 -175.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.757 ' HD3' HD12 ' A' ' 77' ' ' LEU . 15.5 ptt180 -68.56 -22.39 64.49 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.6 -0.44 . . . . 72.450000000000003 110.674 -176.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.4 ttp85 -78.2 -48.72 15.22 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.935 -0.395 . . . . 74.530000000000001 109.935 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 41.4 tp -59.56 -50.36 74.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.602 -0.726 . . . . 52.420000000000002 111.355 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.99 -27.87 68.47 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.929 -0.578 . . . . 73.25 111.917 -177.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.983 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 98.7 m -82.37 -37.35 25.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.791 0.329 . . . . 72.109999999999999 111.277 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -74.42 -44.69 50.73 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.944 0.349 . . . . 50.350000000000001 111.944 -176.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -142.95 35.65 1.39 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 111.851 0.315 . . . . 54.420000000000002 111.851 -174.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -124.63 -79.35 0.39 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.009 -1.091 . . . . 60.409999999999997 112.542 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.681 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -157.62 -56.66 0.08 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.756 0.313 . . . . 64.019999999999996 110.369 -175.099 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.983 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 63.75 12.71 6.87 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.421 -0.809 . . . . 52.340000000000003 112.703 177.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -105.39 -26.56 11.91 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.334 -0.547 . . . . 74.319999999999993 111.191 -176.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 28' ' ' ARG . 13.5 mm-40 -97.84 -3.21 39.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.087 0.47 . . . . 51.43 110.758 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.697 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.7 mp -73.21 135.31 44.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.148 -0.478 . . . . 62.200000000000003 110.636 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 . . . . . 0 C--N 1.326 -0.449 0 CA-C-O 121.326 0.584 . . . . 75.329999999999998 110.581 -178.791 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ttt . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 120.889 0.376 . . . . 71.140000000000001 110.22 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 156.49 155.09 7.27 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 111.368 -0.693 . . . . 44.109999999999999 111.368 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.5 m -153.49 92.89 1.63 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.96 0.41 . . . . 70.329999999999998 110.639 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.2 p -107.83 66.93 0.67 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.453 0.644 . . . . 50.119999999999997 110.327 178.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -156.14 131.35 9.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.329 -0.85 . . . . 72.519999999999996 109.475 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -148.36 152.97 37.95 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.53 -0.304 . . . . 70.319999999999993 110.891 -177.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.6 t-80 -156.53 81.25 0.96 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.491 -0.559 . . . . 74.049999999999997 109.491 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -154.78 76.69 1.01 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.055 -0.52 . . . . 74.319999999999993 110.475 -175.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -177.11 114.17 0.09 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.349 -0.387 . . . . 61.229999999999997 110.962 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -163.58 17.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.026 0.441 . . . . 74.209999999999994 110.618 170.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.9 m -79.97 106.69 12.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.378 -0.373 . . . . 72.400000000000006 110.433 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.0 m -158.07 130.43 7.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.204 -0.453 . . . . 74.340000000000003 110.516 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 123.62 50.7 0.21 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.223 -0.989 . . . . 55.200000000000003 113.261 175.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -102.09 88.89 3.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.955 0.407 . . . . 75.109999999999999 110.512 174.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 115.875 -0.602 . . . . 64.519999999999996 110.662 177.448 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.4 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.1 mp . . . . . 0 CA--C 1.522 -0.111 0 N-CA-C 109.679 -0.489 . . . . 73.239999999999995 109.679 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 ttt180 -134.52 133.31 40.19 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.78 -0.452 . . . . 74.219999999999999 109.78 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.567 ' CA ' ' HG ' ' A' ' 71' ' ' LEU . 1.8 pt-20 -73.28 127.7 33.38 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.097 -0.705 . . . . 71.519999999999996 109.097 -179.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 45.3 tp -104.54 -29.84 10.4 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.579 -0.737 . . . . 65.439999999999998 111.132 -171.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.403 ' CD2' ' HB ' ' A' ' 70' ' ' VAL . 1.6 pt? -163.73 158.67 20.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.045 0.45 . . . . 75.129999999999995 111.253 -176.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -145.8 128.33 16.04 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.567 -0.901 . . . . 73.400000000000006 108.567 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.5 t -143.09 162.15 36.29 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.391 0.615 . . . . 73.040000000000006 111.698 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -106.77 2.03 25.33 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.256 -0.884 . . . . 65.5 110.414 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -96.54 119.9 35.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.981 -0.554 . . . . 75.319999999999993 109.822 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.32 -45.94 68.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.181 -0.463 . . . . 74.019999999999996 111.981 -174.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.2 t -66.51 -46.63 85.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.396 -0.365 . . . . 61.25 111.009 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.8 tp -61.59 -41.5 97.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.766 0.317 . . . . 71.140000000000001 110.396 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.43 HD11 ' HB3' ' A' ' 68' ' ' ARG . 4.7 tt -59.46 -44.55 92.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.937 -0.574 . . . . 61.210000000000001 110.011 177.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.8 m -65.31 -41.54 93.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.868 -0.605 . . . . 71.319999999999993 110.711 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.43 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -62.01 -51.87 66.27 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.084 -0.507 . . . . 61.310000000000002 111.087 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.457 ' HA ' HD12 ' A' ' 41' ' ' LEU . 99.2 t -63.81 -40.46 89.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.089 0.471 . . . . 74.409999999999997 110.927 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.34 -42.24 99.72 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.796 -0.638 . . . . 54.329999999999998 112.297 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.08 -34.03 77.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.805 0.336 . . . . 63.0 110.825 178.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.551 ' HB3' HD21 ' A' ' 83' ' ' LEU . 97.8 mt -62.43 -49.1 76.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.285 0.564 . . . . 73.510000000000005 110.5 177.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.539 HD12 HG11 ' A' ' 70' ' ' VAL . 75.3 mt -70.94 -42.53 69.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.578 -0.737 . . . . 63.310000000000002 111.044 -176.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -67.13 -35.53 79.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.953 0.406 . . . . 64.430000000000007 110.627 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.1 -23.05 72.87 Favored Glycine 0 C--O 1.229 -0.194 0 C-N-CA 121.027 -0.606 . . . . 64.129999999999995 112.281 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.19 11.78 20.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.929 0.395 . . . . 33.530000000000001 110.528 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.0 t70 68.63 6.26 5.37 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.309 -0.86 . . . . 72.340000000000003 111.294 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 60.6 mt -73.6 -24.19 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.648 0.737 . . . . 50.229999999999997 109.042 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.05 -153.43 51.16 Favored Glycine 0 N--CA 1.441 -1.014 0 CA-C-N 114.779 -1.1 . . . . 55.030000000000001 111.573 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -173.15 143.39 1.12 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.654 0.264 . . . . 75.340000000000003 110.702 176.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.897 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 41.8 tp -108.45 88.28 2.69 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 108.781 -0.822 . . . . 62.210000000000001 108.781 168.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.539 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 24.0 m . . . . . 0 C--N 1.325 -0.459 0 CA-C-O 121.974 0.893 . . . . 52.32 109.644 -178.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo . . . . . 0 N--CA 1.463 -0.295 0 N-CA-C 111.421 -0.261 . . . . 72.450000000000003 111.421 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.43 ' HB3' HD11 ' A' ' 35' ' ' LEU . 50.3 ttm-85 -62.03 136.91 58.16 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.058 -0.519 . . . . 64.120000000000005 109.997 -178.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 32.0 ptt180 -122.18 157.59 31.23 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.444 -0.343 . . . . 73.030000000000001 110.476 -175.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.539 HG11 HD12 ' A' ' 42' ' ' LEU . 24.7 t -112.53 116.32 52.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.833 -0.621 . . . . 62.210000000000001 110.393 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.897 ' HB2' ' HB3' ' A' ' 50' ' ' LEU . 8.9 mp -101.99 129.58 48.32 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.08 -0.509 . . . . 63.340000000000003 110.288 176.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 29.5 m -108.94 -173.68 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.585 -0.734 . . . . 52.229999999999997 109.571 177.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -97.59 143.71 28.0 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.839 -0.344 . . . . 74.019999999999996 110.621 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -40.19 -54.61 2.3 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.373 1.249 . . . . 54.43 114.373 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -80.8 -19.07 45.53 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.063 0.458 . . . . 73.450000000000003 111.196 -171.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -83.2 2.24 36.66 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.832 -0.622 . . . . 75.430000000000007 110.783 -177.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -54.89 -44.65 74.31 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.424 -0.353 . . . . 54.240000000000002 110.673 176.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.37 83.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.99 -0.55 . . . . 41.439999999999998 111.177 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -69.1 -46.7 57.48 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.661 -0.781 . . . . 41.310000000000002 111.862 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.21 96.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.681 -0.259 . . . . 73.219999999999999 111.582 -178.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 55.2 mtp85 -59.0 -48.64 80.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.998 -0.547 . . . . 64.409999999999997 111.357 -178.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -64.58 -45.69 85.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.989 0.423 . . . . 62.049999999999997 110.564 179.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.551 HD21 ' HB3' ' A' ' 41' ' ' LEU . 59.4 tp -55.67 -55.58 30.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.283 -0.872 . . . . 74.120000000000005 111.802 -175.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 68.7 mt -69.21 -32.06 71.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.243 -0.435 . . . . 71.129999999999995 111.745 -176.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 82.5 m -72.35 -44.84 62.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.599 0.238 . . . . 70.109999999999999 111.218 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -69.73 -25.65 63.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.032 0.444 . . . . 64.0 110.542 -178.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.66 -10.48 59.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.965 -0.562 . . . . 72.109999999999999 110.941 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 72.94 30.35 63.54 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.222 -0.513 . . . . 34.100000000000001 112.73 178.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.4 mt -118.29 17.74 13.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.055 0.455 . . . . 72.340000000000003 111.057 -178.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.632 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -77.83 85.43 4.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.252 -0.431 . . . . 60.439999999999998 110.29 178.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -141.18 -40.37 0.39 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.826 -0.624 . . . . 71.109999999999999 110.657 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -88.34 -1.28 57.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.463 -0.335 . . . . 73.319999999999993 111.349 -177.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.632 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.1 mp -65.97 118.42 9.74 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.998 -0.371 . . . . 64.310000000000002 109.998 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 C-N-CA 120.718 -0.393 . . . . 73.239999999999995 111.597 -172.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.5 ttp . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.002 -0.37 . . . . 72.140000000000001 110.002 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -172.46 45.38 0.17 Allowed Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.611 -0.596 . . . . 63.229999999999997 111.611 -179.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.6 p -88.07 83.4 7.01 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.214 0.531 . . . . 65.25 111.064 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t -124.2 113.84 18.84 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.108 -0.701 . . . . 62.200000000000003 109.108 179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -104.6 117.25 33.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.507 -0.315 . . . . 70.329999999999998 110.267 -175.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -145.63 105.67 4.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.179 -0.464 . . . . 75.340000000000003 109.862 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -168.23 32.92 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.306 0.575 . . . . 71.519999999999996 109.664 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 -80.66 129.51 34.56 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.774 -0.648 . . . . 70.430000000000007 110.886 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -141.1 107.73 5.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.274 -0.421 . . . . 61.149999999999999 110.754 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.464 ' HA ' ' OD2' ' A' ' 46' ' ' ASP . 55.8 t-80 -60.98 107.67 0.75 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.932 -0.576 . . . . 75.319999999999993 110.799 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.403 ' H ' ' HB3' ' A' ' 46' ' ' ASP . 16.4 m -116.9 -1.01 12.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.122 0.487 . . . . 54.409999999999997 111.067 -178.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.6 p -87.52 88.99 7.83 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.243 0.544 . . . . 63.149999999999999 110.779 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -122.42 63.9 0.52 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.651 -0.785 . . . . 33.130000000000003 112.844 -177.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -163.03 111.18 1.26 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.982 0.42 . . . . 74.530000000000001 111.742 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.652 0 N-CA-C 108.416 -0.957 . . . . 63.210000000000001 108.416 169.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.476 HD22 HD22 ' A' ' 50' ' ' LEU . 6.6 mp . . . . . 0 N--CA 1.455 -0.221 0 CA-C-O 120.816 0.341 . . . . 72.439999999999998 110.893 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -127.41 155.77 43.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.837 -0.62 . . . . 70.25 110.957 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.845 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 42.7 tt0 -74.92 117.4 16.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.98 -0.555 . . . . 64.530000000000001 110.378 -179.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 26' ' ' LEU . 10.0 mt -86.1 -45.34 11.48 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.069 -0.514 . . . . 73.219999999999999 111.566 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.1 tp -140.04 139.77 36.03 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.084 -0.507 . . . . 73.219999999999999 111.262 -165.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -115.49 94.94 4.92 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.331 -0.85 . . . . 73.239999999999995 108.712 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.423 ' O ' ' HB3' ' A' ' 68' ' ' ARG . 43.0 m -137.74 104.74 5.39 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.247 0.546 . . . . 73.25 112.403 -169.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -89.74 -1.05 57.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.246 0.546 . . . . 73.299999999999997 109.727 174.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -68.88 -33.98 74.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.142 -0.936 . . . . 75.209999999999994 111.682 -176.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 73.23 -50.85 0.7 Allowed 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.663 0.785 . . . . 75.219999999999999 112.096 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 56.3 t -66.64 -49.15 77.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.689 0.28 . . . . 62.020000000000003 110.521 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.5 tp -56.93 -38.29 72.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.197 0.522 . . . . 75.099999999999994 110.287 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.404 ' O ' HD23 ' A' ' 35' ' ' LEU . 6.0 tt -63.69 -32.75 74.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 74.540000000000006 110.562 -179.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.7 m -61.83 -37.04 82.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.995 0.426 . . . . 61.310000000000002 110.888 -179.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.3 -42.99 74.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 73.230000000000004 110.649 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 85.1 t -67.14 -42.49 88.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.008 -0.542 . . . . 74.420000000000002 110.612 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.96 -35.03 89.96 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.773 -0.649 . . . . 44.310000000000002 112.486 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -32.89 74.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.708 0.289 . . . . 63.109999999999999 110.796 178.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.3 mt -69.31 -49.5 55.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.462 . . . . 71.209999999999994 110.477 178.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.566 ' HA ' HD12 ' A' ' 47' ' ' ILE . 76.2 mt -62.75 -55.16 29.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.703 -0.68 . . . . 64.109999999999999 111.077 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.37 -25.07 67.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 64.209999999999994 111.214 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.53 -30.65 75.11 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 121.062 -0.589 . . . . 74.219999999999999 112.431 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -109.76 8.16 24.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.963 0.411 . . . . 53.310000000000002 110.63 178.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.464 ' OD2' ' HA ' ' A' ' 10' ' ' HIS . 26.2 t0 56.52 43.24 26.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 122.021 0.915 . . . . 63.549999999999997 110.623 -175.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.566 HD12 ' HA ' ' A' ' 42' ' ' LEU . 68.0 mt -67.66 -27.46 38.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 114.949 -1.023 . . . . 71.329999999999998 109.816 174.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.56 -178.79 35.52 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.163 -0.926 . . . . 73.439999999999998 111.468 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -165.81 125.31 1.69 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.018 0.437 . . . . 75.510000000000005 111.618 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.671 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 61.7 tp -105.88 100.14 9.7 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 107.988 -1.115 . . . . 73.329999999999998 107.988 166.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.434 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 21.9 m . . . . . 0 C--N 1.319 -0.729 0 CA-C-N 116.473 -0.331 . . . . 50.340000000000003 111.755 -172.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 N--CA 1.452 -0.96 0 CA-C-O 121.141 0.392 . . . . 65.430000000000007 111.41 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 29' ' ' THR . 24.0 ttm180 -72.97 117.85 15.2 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.268 -0.642 . . . . 73.109999999999999 109.268 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.434 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 8.9 ptp85 -113.84 134.48 54.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.783 -0.644 . . . . 72.140000000000001 111.236 -172.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 24.4 t -101.71 127.43 55.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.896 -0.593 . . . . 72.400000000000006 110.526 174.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.845 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.9 mp -121.66 147.68 45.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.794 -0.185 . . . . 63.329999999999998 111.115 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.515 HG23 HD22 ' A' ' 77' ' ' LEU . 35.7 m -134.67 178.76 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 109.441 -0.577 . . . . 72.530000000000001 109.441 173.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 23' ' ' LEU . 7.4 p80 -96.65 177.14 5.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.73 0.3 . . . . 63.310000000000002 111.635 -174.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.24 169.43 8.73 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.142 -0.481 . . . . 61.109999999999999 111.855 -178.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.1 t70 66.77 -65.39 0.21 Allowed 'General case' 0 N--CA 1.471 0.587 0 O-C-N 124.03 0.831 . . . . 64.319999999999993 109.877 -174.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -54.32 -26.56 30.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.677 -1.147 . . . . 70.420000000000002 111.164 176.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.515 HD22 HG23 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -50.03 -40.66 45.55 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.798 -0.637 . . . . 62.240000000000002 110.554 178.357 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.52 -41.46 69.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 54.109999999999999 110.872 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.23 -45.33 81.59 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.085 -0.579 . . . . 74.349999999999994 112.145 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.34 93.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.653 0.263 . . . . 75.150000000000006 110.855 178.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 30.1 mtp180 -60.2 -48.71 80.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.448 -0.342 . . . . 75.340000000000003 110.717 177.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -59.34 -40.52 86.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.062 -0.517 . . . . 73.319999999999993 110.688 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 42.0 tp -61.79 -49.45 76.31 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.888 -0.596 . . . . 73.299999999999997 110.809 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.6 mp -68.28 -29.03 67.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.088 -0.505 . . . . 51.039999999999999 111.4 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 51.1 m -69.56 -45.27 69.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.764 0.316 . . . . 53.219999999999999 110.251 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -62.4 -36.93 83.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 74.129999999999995 110.832 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.26 -18.09 60.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.92 -0.582 . . . . 74.099999999999994 111.153 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 83.02 23.37 55.53 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.123 -0.56 . . . . 55.140000000000001 113.02 177.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.1 mt -107.01 -3.03 20.51 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 122.541 -0.388 . . . . 51.32 111.186 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.781 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -75.56 86.23 2.65 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.352 -0.385 . . . . 61.240000000000002 111.152 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -147.16 -43.26 0.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.113 -0.494 . . . . 64.409999999999997 110.757 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -91.75 18.53 7.51 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.35 0.595 . . . . 60.299999999999997 110.69 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.781 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.7 mp -82.18 167.02 19.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.66 -0.7 . . . . 73.439999999999998 111.525 -177.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.597 ' HD2' ' OE1' ' A' ' 25' ' ' GLU . 28.0 ttt180 . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 115.471 -0.786 . . . . 71.319999999999993 109.4 177.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mpp? . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 110.085 -0.339 . . . . 72.109999999999999 110.085 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -174.17 70.15 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.998 -0.62 . . . . 71.019999999999996 111.839 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 m -106.94 26.18 10.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.976 0.417 . . . . 53.399999999999999 110.395 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.2 m -92.1 112.33 24.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.462 0.649 . . . . 55.439999999999998 111.525 -175.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.1 m170 -118.84 113.21 20.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.598 -0.728 . . . . 73.430000000000007 109.724 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -110.52 115.3 29.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.06 0.457 . . . . 74.019999999999996 109.903 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.4 p80 -151.76 134.74 15.74 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.973 -0.558 . . . . 73.349999999999994 110.429 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -150.97 123.66 8.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.833 -0.621 . . . . 73.0 110.086 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.76 88.54 1.41 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.355 -0.384 . . . . 71.230000000000004 110.551 -175.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -164.25 134.11 4.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.277 -0.638 . . . . 72.219999999999999 109.277 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.2 m -157.61 110.74 2.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.639 0.257 . . . . 63.539999999999999 111.282 -178.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 p -166.23 143.72 5.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 42.43 110.441 174.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 150.04 108.4 0.44 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.89 -0.672 . . . . 74.25 112.114 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 -173.41 -60.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.985 0.421 . . . . 72.099999999999994 110.383 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.438 -0.801 . . . . 72.120000000000005 111.816 -172.399 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.553 HD21 HD13 ' A' ' 50' ' ' LEU . 5.7 mp . . . . . 0 C--O 1.234 0.255 0 N-CA-C 110.149 -0.315 . . . . 74.329999999999998 110.149 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 24' ' ' ARG . 50.6 mtm180 -111.34 170.32 8.2 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.996 -0.372 . . . . 74.439999999999998 109.996 173.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.669 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 36.6 tt0 -81.82 135.06 35.47 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.79 0.329 . . . . 72.049999999999997 111.29 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.837 HD21 HG22 ' A' ' 72' ' ' VAL . 4.4 mm? -97.23 -67.19 0.86 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.056 -0.52 . . . . 71.340000000000003 110.034 175.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.633 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -142.82 157.9 44.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.24 -0.437 . . . . 72.430000000000007 110.559 177.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -138.01 101.73 4.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.828 -0.804 . . . . 63.509999999999998 108.828 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.0 t -113.59 170.25 8.38 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.242 -0.436 . . . . 74.310000000000002 110.525 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.512 HD22 ' HG2' ' A' ' 67' ' ' PRO . 11.1 m120 -104.57 -3.78 23.42 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.066 0.46 . . . . 74.530000000000001 109.768 177.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -105.98 156.71 18.1 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.734 -0.666 . . . . 73.430000000000007 111.174 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.73 -15.13 11.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.199 -0.455 . . . . 73.109999999999999 110.999 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 82.5 t -71.75 -49.51 45.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.007 0.432 . . . . 74.040000000000006 110.744 -177.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.4 tp -59.86 -31.78 70.09 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.886 -0.597 . . . . 72.109999999999999 110.684 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 76.3 mt -67.58 -22.98 65.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.506 . . . . 73.200000000000003 111.54 -178.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.6 m -67.97 -36.9 80.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.007 0.432 . . . . 73.129999999999995 110.238 176.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -72.18 -45.35 60.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 74.109999999999999 110.317 177.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.7 t -63.81 -42.77 96.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.76 -0.654 . . . . 61.549999999999997 110.972 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.35 -37.42 94.03 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.816 -0.629 . . . . 62.229999999999997 112.239 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.42 -31.3 72.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.758 0.314 . . . . 75.25 111.006 178.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 91.0 mt -70.42 -51.02 32.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.959 0.409 . . . . 73.129999999999995 110.159 177.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.672 ' HA ' HD12 ' A' ' 47' ' ' ILE . 48.3 mt -58.67 -52.87 63.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.602 -0.726 . . . . 72.319999999999993 110.969 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -67.75 -34.35 76.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.601 -0.727 . . . . 54.130000000000003 111.168 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.62 -15.2 61.51 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 116.12 -0.491 . . . . 63.25 112.443 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -100.76 -65.58 0.96 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.563 0.221 . . . . 64.329999999999998 110.609 176.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.0 t70 164.37 -19.78 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.402 -0.817 . . . . 73.329999999999998 109.09 -173.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.672 HD12 ' HA ' ' A' ' 42' ' ' LEU . 23.9 mt -51.04 106.41 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 114.179 -1.373 . . . . 74.219999999999999 112.869 -166.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.59 114.16 6.44 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.414 -0.812 . . . . 40.109999999999999 111.274 173.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -127.34 130.45 49.47 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.931 0.396 . . . . 75.319999999999993 110.647 -173.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.553 HD13 HD21 ' A' ' 23' ' ' LEU . 8.7 mp -106.66 112.16 25.02 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.858 -0.61 . . . . 75.319999999999993 110.05 179.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 C--N 1.323 -0.564 0 CA-C-N 115.86 -0.609 . . . . 64.450000000000003 110.512 179.143 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.512 ' HG2' HD22 ' A' ' 30' ' ' ASN . 21.9 Cg_exo . . . . . 0 N--CA 1.463 -0.272 0 CA-C-O 120.633 0.181 . . . . 71.319999999999993 111.76 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -158.08 116.63 3.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.11 -0.495 . . . . 75.340000000000003 110.367 175.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -113.91 132.41 55.94 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.739 -0.664 . . . . 75.109999999999999 109.33 177.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.402 ' C ' HD12 ' A' ' 71' ' ' LEU . 52.2 t -109.74 118.49 56.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.405 -0.361 . . . . 61.219999999999999 110.448 -177.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.669 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.5 mp -125.74 144.37 50.65 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.996 -0.547 . . . . 62.200000000000003 109.914 177.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.837 HG22 HD21 ' A' ' 26' ' ' LEU . 33.2 m -127.68 165.66 26.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.931 -0.396 . . . . 75.340000000000003 109.931 177.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.488 ' ND1' ' HB3' ' A' ' 75' ' ' ASP . 0.4 OUTLIER -69.59 133.82 48.06 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.582 -0.281 . . . . 62.539999999999999 110.504 178.307 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.481 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 43.7 mm-40 -51.5 -28.46 13.55 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.137 0.575 . . . . 72.549999999999997 111.945 -177.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.488 ' HB3' ' ND1' ' A' ' 73' ' ' HIS . 34.9 t70 -58.4 -17.7 22.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.453 -0.794 . . . . 71.0 112.124 -179.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -131.59 13.24 4.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.157 0.503 . . . . 71.510000000000005 109.928 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -57.3 -51.21 70.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.983 -0.553 . . . . 73.099999999999994 110.883 -174.441 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.16 -36.2 82.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.904 -0.589 . . . . 54.32 111.459 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.61 -47.39 21.32 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.627 -0.797 . . . . 71.230000000000004 111.956 -179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.05 -44.67 87.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.691 0.256 . . . . 71.400000000000006 111.691 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -59.68 -49.13 78.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.695 -0.229 . . . . 63.229999999999997 111.575 -177.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -65.56 -35.28 80.39 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.424 -0.51 . . . . 72.400000000000006 110.712 -178.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.2 tp -61.97 -43.07 99.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.932 0.396 . . . . 75.329999999999998 110.211 178.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.73 -28.54 66.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.0 -0.546 . . . . 74.310000000000002 111.236 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.41 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 19.2 m -77.33 -48.81 16.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.164 0.507 . . . . 64.010000000000005 110.781 176.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.04 -44.39 76.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.167 -0.924 . . . . 65.019999999999996 112.122 -171.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -123.06 28.3 7.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.89 0.376 . . . . 44.43 111.747 -175.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -139.96 -80.98 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.103 -1.046 . . . . 73.540000000000006 112.252 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.54 HD13 ' OE1' ' A' ' 92' ' ' GLU . 0.6 OUTLIER -179.12 -57.12 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 122.321 0.248 . . . . 63.009999999999998 111.187 -173.434 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.988 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . 60.12 20.99 10.24 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.025 0.53 . . . . 74.439999999999998 112.055 -177.048 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . 0.476 ' H ' HD12 ' A' ' 89' ' ' LEU . 57.1 t-80 -100.67 -29.27 12.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.089 0.471 . . . . 73.129999999999995 110.651 -176.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.54 ' OE1' HD13 ' A' ' 89' ' ' LEU . 5.4 mp0 -94.75 6.96 47.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.823 -0.626 . . . . 75.450000000000003 110.701 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.988 HD13 ' HA ' ' A' ' 90' ' ' ALA . 11.1 mp -73.13 150.61 42.08 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.205 -0.452 . . . . 74.150000000000006 110.701 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 94' ' ' ARG . 22.3 ttt85 . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 115.533 -0.758 . . . . 72.340000000000003 109.755 -173.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 mmt . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.748 0.308 . . . . 52.439999999999998 110.201 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 106.98 56.9 0.61 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.929 -0.653 . . . . 63.329999999999998 112.299 177.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.7 m -116.82 78.54 1.22 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.037 0.446 . . . . 71.230000000000004 110.697 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.2 m -127.03 144.52 51.0 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.08 -0.509 . . . . 73.010000000000005 110.435 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -134.71 101.58 4.98 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.182 -0.673 . . . . 62.149999999999999 109.182 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.7 t60 -135.58 125.94 26.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.856 -0.611 . . . . 75.439999999999998 111.165 -172.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -150.3 132.98 15.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.157 -0.474 . . . . 70.129999999999995 109.903 173.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 t60 -132.8 108.95 9.31 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.724 -0.473 . . . . 72.420000000000002 109.724 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -152.04 98.5 2.44 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.302 -0.408 . . . . 74.439999999999998 111.107 -175.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -157.14 113.0 2.9 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.354 0.597 . . . . 55.530000000000001 110.344 173.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.7 m -134.5 137.23 43.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.6 -0.727 . . . . 75.129999999999995 109.661 178.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.3 m -139.55 167.04 22.99 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.038 -0.528 . . . . 73.209999999999994 110.122 -176.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 141.51 85.52 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.131 -1.033 . . . . 75.109999999999999 113.728 174.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 17.1 ptt180 -149.82 100.88 3.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.233 0.539 . . . . 73.439999999999998 110.692 172.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.375 0 CA-C-N 116.019 -0.537 . . . . 73.140000000000001 110.275 178.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 93.2 mt . . . . . 0 N--CA 1.467 0.393 0 CA-C-O 121.205 0.526 . . . . 72.230000000000004 110.509 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.529 ' HB2' HD21 ' A' ' 77' ' ' LEU . 27.8 mmm180 -132.74 127.52 34.88 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.992 -0.442 . . . . 62.009999999999998 110.889 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.546 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 42.5 tt0 -70.56 120.93 16.92 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.557 -0.747 . . . . 74.340000000000003 109.05 174.464 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.46 HD12 HD22 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -79.6 -51.96 8.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.889 0.376 . . . . 74.530000000000001 110.098 -174.895 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.46 HD22 HD12 ' A' ' 26' ' ' LEU . 2.7 pt? -157.4 154.53 29.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.177 -0.465 . . . . 74.430000000000007 110.701 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.569 ' HG3' ' HB3' ' A' ' 69' ' ' ARG . 22.1 ttm180 -131.7 111.41 11.65 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.702 -0.851 . . . . 74.239999999999995 108.702 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.7 t -126.92 164.7 20.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.138 0.494 . . . . 72.340000000000003 111.523 -173.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.444 ' ND2' ' HB3' ' A' ' 67' ' ' PRO . 8.1 m120 -107.88 -6.89 16.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.655 -0.702 . . . . 74.439999999999998 109.955 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -95.45 134.47 38.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.763 -0.653 . . . . 74.129999999999995 111.332 -175.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.35 -33.26 49.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.813 -0.63 . . . . 73.400000000000006 111.587 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.1 t -59.96 -47.44 91.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 120.93 0.395 . . . . 63.049999999999997 110.69 -177.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.3 tp -62.22 -40.24 95.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.672 -0.695 . . . . 75.340000000000003 110.572 178.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.63 -43.41 98.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 63.520000000000003 111.081 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.6 m -59.5 -40.78 88.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.791 0.329 . . . . 55.420000000000002 111.016 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -71.97 -54.64 9.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.117 -0.492 . . . . 42.210000000000001 111.181 -177.528 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.403 HG13 HD21 ' A' ' 84' ' ' LEU . 86.9 t -61.26 -39.53 82.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.194 0.521 . . . . 73.450000000000003 110.315 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.82 -49.0 80.33 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.351 -0.841 . . . . 71.040000000000006 112.262 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.28 -33.02 74.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.639 0.257 . . . . 71.540000000000006 111.305 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 95.0 mt -65.68 -51.78 56.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.323 -0.399 . . . . 63.420000000000002 110.678 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.6 mt -74.39 -27.3 60.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.113 -0.494 . . . . 71.040000000000006 110.671 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -74.91 -55.63 5.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.13 -0.486 . . . . 61.520000000000003 110.631 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.66 -36.2 92.06 Favored Glycine 0 C--N 1.332 0.31 0 CA-C-N 115.698 -0.683 . . . . 70.310000000000002 112.84 -175.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.487 ' HB3' HG12 ' A' ' 47' ' ' ILE . . . -82.81 -1.69 52.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.763 0.316 . . . . 72.219999999999999 110.747 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.2 t70 60.72 26.78 16.55 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.462 0.648 . . . . 74.319999999999993 111.067 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.487 HG12 ' HB3' ' A' ' 45' ' ' ALA . 47.2 mm -63.64 -39.32 84.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.532 0.682 . . . . 52.219999999999999 110.106 -179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 110.64 125.79 4.9 Favored Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.208 -0.905 . . . . 61.539999999999999 112.276 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -139.0 141.81 38.32 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.71 0.291 . . . . 73.010000000000005 110.683 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.6 90.67 3.37 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.313 -0.995 . . . . 74.319999999999993 108.313 171.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.9 m . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.974 -0.557 . . . . 72.409999999999997 111.499 -175.581 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . 0.444 ' HB3' ' ND2' ' A' ' 30' ' ' ASN . 37.3 Cg_endo . . . . . 0 C--O 1.235 0.345 0 CA-C-O 120.932 0.305 . . . . 61.229999999999997 111.708 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.486 ' HA ' ' HD2' ' A' ' 68' ' ' ARG . 10.1 tpt180 -100.87 140.81 34.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.38 0.61 . . . . 72.310000000000002 110.985 -177.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.569 ' HB3' ' HG3' ' A' ' 28' ' ' ARG . 28.3 ptt180 -113.61 146.69 39.35 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.135 -0.939 . . . . 74.109999999999999 110.357 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 64.6 t -110.04 116.75 53.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.415 -0.357 . . . . 61.409999999999997 110.444 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.7 mp -102.79 137.62 40.76 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.548 -0.538 . . . . 65.209999999999994 109.548 174.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 25.3 m -114.99 176.9 2.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.227 -0.442 . . . . 65.340000000000003 110.504 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -69.9 129.33 39.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.686 -0.688 . . . . 75.319999999999993 109.519 176.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.401 ' H ' ' HG2' ' A' ' 74' ' ' GLU . 5.9 pt-20 -57.75 -35.93 71.39 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.006 0.431 . . . . 64.049999999999997 111.125 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.6 -16.91 61.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.731 -0.668 . . . . 63.409999999999997 110.142 -176.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -111.33 23.62 13.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.964 -0.562 . . . . 71.540000000000006 110.093 -175.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.529 HD21 ' HB2' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -51.32 -50.86 58.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.753 -0.658 . . . . 71.099999999999994 110.711 -178.436 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.13 -28.37 66.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.019 -0.537 . . . . 64.319999999999993 111.622 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.42 -57.23 5.18 Favored Glycine 0 C--O 1.236 0.23 0 C-N-CA 120.718 -0.754 . . . . 71.409999999999997 112.611 -175.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.38 -42.87 96.75 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.889 0.329 . . . . 73.120000000000005 111.889 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 14.6 ptm180 -67.22 -33.23 74.91 Favored 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 120.943 -0.303 . . . . 72.329999999999998 110.91 -178.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -63.0 -42.28 99.81 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.016 0.436 . . . . 73.530000000000001 109.852 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 34.8 tp -58.49 -46.99 85.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.6 -0.727 . . . . 70.239999999999995 110.451 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.403 HD21 HG13 ' A' ' 38' ' ' VAL . 84.0 mt -68.49 -32.46 72.47 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.768 -0.651 . . . . 64.310000000000002 111.226 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.6 m -70.37 -36.82 74.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.975 0.417 . . . . 61.039999999999999 110.551 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -69.04 -40.58 78.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.019 -0.537 . . . . 64.019999999999996 110.445 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.48 -30.16 69.78 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.868 -0.605 . . . . 73.200000000000003 111.044 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 100.29 -13.79 59.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.121 -0.562 . . . . 73.319999999999993 112.673 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 61.6 mt -78.91 1.9 21.99 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.178 0.436 . . . . 63.530000000000001 112.178 -176.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -75.73 91.32 2.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.056 0.455 . . . . 62.119999999999997 109.827 175.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -140.46 -40.32 0.42 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.904 -0.589 . . . . 75.129999999999995 110.001 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.6 mp0 -87.39 29.63 0.85 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.627 -0.715 . . . . 71.340000000000003 111.492 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.552 HD12 ' H ' ' A' ' 93' ' ' LEU . 4.1 mp -62.81 145.1 55.76 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.705 0.288 . . . . 70.140000000000001 110.482 -178.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.431 ' HD2' ' HA ' ' A' ' 94' ' ' ARG . 2.3 tpt180 . . . . . 0 C--N 1.323 -0.585 0 N-CA-C 109.728 -0.471 . . . . 71.450000000000003 109.728 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.484 1.255 0 CA-C-O 120.529 0.204 . . . . 72.25 110.986 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.18 127.59 0.92 Allowed Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 120.222 -0.99 . . . . 54.119999999999997 113.065 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.2 p -153.4 82.24 1.18 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.224 -0.658 . . . . 63.409999999999997 109.224 173.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.3 p -89.51 117.76 28.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.78 -0.645 . . . . 74.140000000000001 111.471 -172.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -139.37 111.44 7.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.087 -0.708 . . . . 73.430000000000007 109.087 176.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.6 p-80 -153.38 107.26 3.04 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.081 0.467 . . . . 70.140000000000001 111.18 -177.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -150.7 102.34 3.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.893 -0.594 . . . . 73.030000000000001 111.138 175.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -140.79 118.86 11.92 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.351 -0.611 . . . . 74.209999999999994 109.351 171.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -146.13 95.22 2.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.224 -0.444 . . . . 72.400000000000006 110.639 -177.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -131.76 53.23 2.01 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.814 -0.81 . . . . 64.010000000000005 108.814 174.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -72.46 90.87 1.34 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.324 -0.853 . . . . 72.200000000000003 110.813 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.3 p -121.4 -178.13 3.71 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.84 -0.618 . . . . 75.209999999999994 110.32 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 106.76 90.17 2.14 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.779 -0.724 . . . . 64.019999999999996 111.691 -179.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 14' ' ' ARG . 10.4 ttp180 -76.64 -65.17 0.97 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.641 -0.503 . . . . 62.329999999999998 109.641 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.302 -0.863 . . . . 55.240000000000002 110.093 -176.142 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.767 HD22 ' HB2' ' A' ' 50' ' ' LEU . 7.4 mp . . . . . 0 CA--C 1.531 0.242 0 CA-C-O 121.665 0.745 . . . . 64.530000000000001 111.518 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.634 ' HB2' HD11 ' A' ' 77' ' ' LEU . 13.1 mmt180 -115.2 133.18 56.27 Favored 'General case' 0 C--N 1.321 -0.668 0 O-C-N 121.831 -0.543 . . . . 65.530000000000001 110.545 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.589 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.5 tt0 -66.93 126.96 30.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.22 -0.9 . . . . 75.329999999999998 110.409 -176.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.477 ' CD1' ' HG2' ' A' ' 81' ' ' ARG . 20.2 tp -106.61 -58.21 1.96 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.41 -0.814 . . . . 72.040000000000006 110.772 -175.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.842 ' HB3' HD23 ' A' ' 93' ' ' LEU . 4.6 pp -147.71 167.99 23.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.388 -0.369 . . . . 63.549999999999997 110.1 178.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.538 ' HD2' ' O ' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -148.02 143.91 27.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.88 0.372 . . . . 75.129999999999995 111.527 179.213 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.8 t -174.02 163.17 3.96 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.605 -0.725 . . . . 62.310000000000002 109.995 178.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -100.06 -4.23 30.3 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.958 0.409 . . . . 54.25 109.924 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.8 117.68 17.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.766 -0.652 . . . . 75.439999999999998 110.344 -177.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.514 ' HB2' HH22 ' A' ' 68' ' ' ARG . . . -74.57 -38.44 62.68 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.323 -0.399 . . . . 64.109999999999999 111.263 -176.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.2 t -63.44 -46.44 95.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.088 0.471 . . . . 63.530000000000001 110.459 -177.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 tp -61.39 -39.95 92.56 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.696 -0.684 . . . . 70.450000000000003 110.584 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.556 ' HA ' HG12 ' A' ' 38' ' ' VAL . 80.9 mt -72.11 -24.65 61.52 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.957 -0.565 . . . . 75.239999999999995 111.514 -178.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -75.05 -27.59 60.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.945 0.403 . . . . 53.32 110.306 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.62 -53.74 7.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 71.409999999999997 110.582 177.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.73 HG21 HD21 ' A' ' 27' ' ' LEU . 7.2 p -64.92 -35.37 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 120.915 0.388 . . . . 65.439999999999998 111.153 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.37 -38.97 95.53 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.004 -0.617 . . . . 64.439999999999998 112.307 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.96 -29.98 70.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.878 0.371 . . . . 65.200000000000003 111.135 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 88.0 mt -69.39 -49.18 57.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.127 -0.488 . . . . 63.210000000000001 109.968 178.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.9 mt -66.15 -35.0 79.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.672 -0.695 . . . . 74.109999999999999 110.589 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.12 -52.43 48.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.769 -0.651 . . . . 73.109999999999999 110.737 176.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.53 -26.88 73.57 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.689 -0.687 . . . . 71.230000000000004 113.966 -173.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.02 9.11 37.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.835 0.318 . . . . 74.430000000000007 111.826 -177.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.6 t70 61.17 29.13 18.63 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.753 0.787 . . . . 73.510000000000005 110.732 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.3 mt -84.26 -47.62 17.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.541 0.686 . . . . 65.209999999999994 110.185 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.21 172.74 38.67 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.083 -0.962 . . . . 73.439999999999998 111.601 -176.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -169.24 142.13 2.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.946 0.403 . . . . 73.239999999999995 111.406 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.767 ' HB2' HD22 ' A' ' 23' ' ' LEU . 1.9 tm? -97.19 102.25 13.98 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.355 -0.98 . . . . 74.230000000000004 108.355 172.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.7 m . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.977 -0.556 . . . . 64.129999999999995 110.468 -179.611 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo . . . . . 0 N--CA 1.458 -0.581 0 N-CA-C 110.237 -0.717 . . . . 73.340000000000003 110.237 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.514 HH22 ' HB2' ' A' ' 32' ' ' ALA . 64.5 mtm180 -75.83 126.46 31.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.671 0.748 . . . . 73.140000000000001 112.337 -170.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -113.13 131.43 55.84 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.584 -1.189 . . . . 72.329999999999998 108.023 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 55.5 t -101.45 111.6 31.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-O 120.769 0.319 . . . . 75.439999999999998 110.772 -172.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.658 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 7.7 mp -102.73 142.73 33.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.639 -0.71 . . . . 74.0 109.104 174.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 20.6 m -119.96 174.26 5.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.204 0.526 . . . . 73.329999999999998 111.484 -174.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -57.69 121.89 11.48 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.812 -1.086 . . . . 64.049999999999997 110.949 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.565 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 36.9 mt-10 -62.87 154.0 31.47 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.879 -0.6 . . . . 71.219999999999999 109.459 177.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.565 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 8.6 t70 78.92 -16.79 0.64 Allowed 'General case' 0 N--CA 1.473 0.689 0 O-C-N 123.921 0.763 . . . . 71.349999999999994 111.213 -173.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.36 16.87 25.25 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.159 0.504 . . . . 73.219999999999999 110.246 -177.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.634 HD11 ' HB2' ' A' ' 24' ' ' ARG . 4.2 mm? -60.94 -49.09 78.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.671 -0.695 . . . . 61.340000000000003 111.295 -177.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.42 -22.46 66.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.912 0.387 . . . . 44.409999999999997 111.192 -178.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -84.61 -56.08 2.57 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.642 -0.79 . . . . 64.340000000000003 112.541 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.412 ' O ' HD13 ' A' ' 84' ' ' LEU . . . -61.17 -44.42 97.34 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.749 0.277 . . . . 65.150000000000006 111.749 -176.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.477 ' HG2' ' CD1' ' A' ' 26' ' ' LEU . 18.3 mtp180 -63.13 -36.96 85.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.937 0.399 . . . . 62.130000000000003 110.243 -178.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -68.34 -44.07 76.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.993 -0.548 . . . . 73.420000000000002 110.582 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.5 tp -56.28 -49.87 73.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 74.25 111.019 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.412 HD13 ' O ' ' A' ' 80' ' ' ALA . 9.1 mp -67.67 -28.23 67.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 75.340000000000003 111.416 -178.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.59 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.3 m -81.08 -40.02 24.79 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.47 -0.332 . . . . 74.519999999999996 111.211 -178.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -74.22 -42.28 60.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.27 -0.423 . . . . 63.420000000000002 111.217 -177.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.8 83.82 1.09 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.12 0.486 . . . . 62.109999999999999 110.361 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -170.33 -96.1 0.1 Allowed Glycine 0 N--CA 1.441 -1.01 0 C-N-CA 120.323 -0.942 . . . . 44.299999999999997 112.429 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.623 HD11 ' HB ' ' A' ' 38' ' ' VAL . 1.2 pp -175.0 48.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.197 0.522 . . . . 71.150000000000006 111.182 -172.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.59 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . -68.44 93.79 0.51 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.173 -0.467 . . . . 54.409999999999997 111.587 -177.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -151.14 -47.91 0.12 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.061 -0.518 . . . . 74.530000000000001 110.187 176.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -76.73 -0.3 23.19 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.64 -0.709 . . . . 75.340000000000003 110.869 -178.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.842 HD23 ' HB3' ' A' ' 27' ' ' LEU . 90.5 mt -66.91 140.47 57.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.004 -0.544 . . . . 73.299999999999997 110.671 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 45.3 ttt180 . . . . . 0 C--N 1.324 -0.525 0 C-N-CA 120.85 -0.34 . . . . 74.310000000000002 110.193 175.94 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 109.775 -0.454 . . . . 54.210000000000001 109.775 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 174.82 -62.2 0.11 Allowed Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.591 -0.814 . . . . 55.439999999999998 112.216 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.4 m -105.38 101.13 10.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.863 0.363 . . . . 61.329999999999998 110.538 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.2 p -121.69 107.63 12.58 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.041 -0.527 . . . . 64.340000000000003 110.4 177.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -113.58 127.07 55.93 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.548 0.689 . . . . 73.219999999999999 111.505 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -157.04 93.75 1.36 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.889 -1.051 . . . . 72.230000000000004 108.699 175.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -148.8 154.68 39.88 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.367 -0.833 . . . . 60.409999999999997 110.33 -173.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.1 p-80 -156.39 143.12 18.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.826 0.346 . . . . 64.409999999999997 110.739 -177.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -139.82 91.19 2.45 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.944 -0.571 . . . . 71.400000000000006 109.487 177.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -142.0 109.05 5.47 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.047 0.451 . . . . 74.030000000000001 110.563 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.7 t -82.13 -175.78 5.82 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.697 -0.683 . . . . 70.319999999999993 109.376 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.8 m -81.15 78.54 7.94 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.055 0.455 . . . . 74.219999999999999 110.391 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -118.46 134.13 10.74 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.881 -0.675 . . . . 71.219999999999999 111.802 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 14' ' ' ARG . 30.6 ttt180 -164.41 125.54 2.17 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.829 0.347 . . . . 73.420000000000002 110.287 -179.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.319 -0.76 0 N-CA-C 109.411 -0.589 . . . . 63.539999999999999 109.411 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . 72.8 mt . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.552 0.215 . . . . 74.420000000000002 110.674 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.783 HH11 ' HG ' ' A' ' 77' ' ' LEU . 43.1 mtp180 -126.31 135.36 51.41 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.895 -0.409 . . . . 70.0 109.895 174.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.532 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.7 tt0 -68.77 110.47 4.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.04 -0.527 . . . . 74.209999999999994 109.711 177.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.5 tp -88.82 -52.18 5.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 111.131 -174.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.463 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 2.4 pt? -151.41 149.12 28.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.568 -0.287 . . . . 74.540000000000006 110.46 179.2 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -139.59 137.34 35.28 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.979 -0.378 . . . . 74.120000000000005 109.979 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.1 t -156.39 -175.7 5.57 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.143 -0.481 . . . . 73.530000000000001 109.973 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -106.78 -3.19 20.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.012 0.434 . . . . 71.109999999999999 110.614 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -107.28 134.75 49.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.959 -0.564 . . . . 74.310000000000002 111.252 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -93.76 -17.31 23.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.096 -0.502 . . . . 41.509999999999998 110.941 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t -65.24 -53.24 42.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-O 120.926 0.393 . . . . 74.019999999999996 110.451 -178.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.91 -34.48 78.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.189 -0.459 . . . . 74.010000000000005 110.732 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 66.7 mt -66.94 -32.03 73.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.447 -0.342 . . . . 51.399999999999999 111.032 179.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.9 m -67.52 -28.5 67.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.063 0.459 . . . . 74.150000000000006 110.333 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.87 -42.16 61.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.095 -0.502 . . . . 75.129999999999995 109.926 174.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.609 HG13 HD21 ' A' ' 84' ' ' LEU . 92.6 t -63.17 -45.35 98.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.646 -0.706 . . . . 61.100000000000001 110.721 176.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.47 -40.57 96.36 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.811 -0.632 . . . . 34.420000000000002 112.478 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.44 -33.43 74.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 72.439999999999998 111.184 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 87.2 mt -69.51 -51.28 37.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.147 0.498 . . . . 64.040000000000006 110.223 178.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.95 -47.19 81.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.699 -0.682 . . . . 70.25 110.815 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -66.65 -29.22 69.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 72.340000000000003 110.246 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.55 -28.56 73.11 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 121.094 -0.574 . . . . 65.430000000000007 112.32 178.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -96.45 11.8 33.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.852 0.358 . . . . 74.409999999999997 110.504 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.9 t70 66.86 19.64 10.64 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.561 -0.745 . . . . 74.049999999999997 110.89 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.9 mt -84.46 113.35 23.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.267 -0.424 . . . . 74.219999999999999 109.985 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.26 120.74 23.9 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 115.915 -0.584 . . . . 63.030000000000001 112.431 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -109.27 136.33 48.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.78 0.324 . . . . 75.439999999999998 110.841 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -94.38 94.77 8.46 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.007 -0.738 . . . . 62.229999999999997 109.007 176.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.419 HG22 HG22 ' A' ' 70' ' ' VAL . 20.7 t . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.728 -0.669 . . . . 62.32 110.17 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.458 -0.562 0 CA-C-O 120.974 0.323 . . . . 75.519999999999996 111.262 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.604 ' HA ' ' NE ' ' A' ' 68' ' ' ARG . 2.6 mmp_? -92.9 136.22 33.45 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.228 -0.442 . . . . 74.040000000000006 111.234 -176.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.1 ptt180 -145.02 144.99 31.31 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.753 -0.658 . . . . 70.340000000000003 111.0 -178.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.419 HG22 HG22 ' A' ' 51' ' ' VAL . 53.7 t -105.71 127.42 60.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.906 -0.588 . . . . 73.329999999999998 110.245 179.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.532 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 7.6 mp -113.27 137.78 50.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.153 -0.476 . . . . 70.230000000000004 110.337 178.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.7 m -104.8 160.78 5.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.051 -0.522 . . . . 63.340000000000003 110.572 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.426 ' HA ' HD23 ' A' ' 23' ' ' LEU . 70.8 m-70 -84.47 40.81 0.8 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.512 -0.313 . . . . 75.319999999999993 111.585 -176.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 67.69 -173.2 0.19 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.806 -0.634 . . . . 63.509999999999998 112.401 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 27.2 t70 68.57 -70.76 0.13 Allowed 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 114.678 -1.146 . . . . 61.149999999999999 112.538 177.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.18 40.22 0.54 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.832 0.349 . . . . 71.219999999999999 111.746 -175.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.783 ' HG ' HH11 ' A' ' 24' ' ' ARG . 3.7 mm? -64.29 -49.98 69.69 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.737 -0.468 . . . . 63.32 109.737 175.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.72 -33.46 70.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.852 -0.613 . . . . 55.409999999999997 110.304 178.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.46 -52.48 48.81 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.891 -0.671 . . . . 71.239999999999995 112.138 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.42 86.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.472 0.177 . . . . 60.329999999999998 111.17 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -57.4 -48.82 78.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.487 -0.324 . . . . 64.010000000000005 111.352 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -67.51 -37.29 82.59 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 121.024 -0.27 . . . . 74.340000000000003 110.77 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 60.0 tp -60.62 -51.35 69.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.039 0.447 . . . . 73.109999999999999 110.52 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.609 HD21 HG13 ' A' ' 38' ' ' VAL . 10.5 mp -64.6 -33.79 76.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.907 -0.588 . . . . 72.129999999999995 111.326 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.824 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 95.3 m -66.92 -44.04 81.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.345 -0.389 . . . . 73.430000000000007 110.639 178.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -68.04 -35.29 78.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 71.219999999999999 110.136 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.57 -44.77 93.19 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.765 -0.652 . . . . 72.540000000000006 111.16 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 127.21 -14.78 6.52 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.228 -0.987 . . . . 70.030000000000001 113.602 175.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.511 HD11 ' HG ' ' A' ' 84' ' ' LEU . 1.6 pp -94.79 19.32 10.27 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.321 0.489 . . . . 64.310000000000002 112.321 -175.362 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.834 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -68.63 84.54 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.94 0.4 . . . . 74.319999999999993 110.51 176.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -145.77 -48.05 0.22 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.839 -0.618 . . . . 72.040000000000006 109.883 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -79.87 -7.63 58.83 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.021 0.439 . . . . 62.32 110.543 -179.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.834 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.1 mp -67.09 134.83 52.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.891 -0.595 . . . . 73.030000000000001 110.094 178.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 . . . . . 0 C--N 1.323 -0.551 0 CA-C-O 121.094 0.473 . . . . 54.240000000000002 110.869 -177.217 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 120.769 0.319 . . . . 62.32 110.337 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 95.25 89.69 1.74 Allowed Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.915 -0.659 . . . . 64.209999999999994 111.594 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.3 m -70.36 104.7 2.78 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.026 0.441 . . . . 73.340000000000003 110.733 -178.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 p -120.15 129.53 54.18 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 116.002 -0.544 . . . . 44.229999999999997 111.174 -177.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -147.48 20.62 1.19 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.635 -0.712 . . . . 72.329999999999998 109.677 174.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.9 m80 -109.53 116.94 32.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.042 -0.981 . . . . 72.310000000000002 110.744 179.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -132.66 116.76 17.05 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.844 -0.798 . . . . 72.010000000000005 108.844 170.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -142.86 126.44 16.87 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.871 -0.604 . . . . 72.400000000000006 111.091 -169.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -176.91 154.76 1.15 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.956 -0.565 . . . . 74.409999999999997 110.217 174.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -153.31 89.12 1.33 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.19 0.519 . . . . 62.340000000000003 109.682 175.318 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.3 p -75.07 143.27 43.53 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.771 -0.649 . . . . 72.140000000000001 111.091 -175.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.4 m -144.78 96.33 2.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 74.099999999999994 110.231 178.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -177.72 127.52 1.19 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 121.011 -0.614 . . . . 62.409999999999997 111.675 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -151.22 -31.12 0.17 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.915 0.388 . . . . 75.540000000000006 110.642 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.335 -0.393 . . . . 70.400000000000006 110.042 178.511 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 N--CA 1.453 -0.292 0 CA-C-O 120.912 0.387 . . . . 71.519999999999996 110.524 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.401 ' O ' ' HA ' ' A' ' 71' ' ' LEU . 66.9 mtt180 -113.66 144.42 42.94 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.705 -0.48 . . . . 72.140000000000001 109.705 175.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.531 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 80.3 tt0 -77.11 110.59 11.91 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.783 -1.191 . . . . 72.239999999999995 107.783 172.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.557 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -79.92 -52.62 7.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.941 -0.572 . . . . 62.539999999999999 110.075 -173.011 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.655 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 2.1 pt? -152.52 150.72 29.88 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.735 -0.666 . . . . 71.409999999999997 109.491 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.481 ' HD2' ' OE2' ' A' ' 25' ' ' GLU . 8.7 ptm85 -132.53 121.56 23.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.282 0.563 . . . . 72.230000000000004 110.206 176.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.8 t -119.25 168.87 10.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.507 -0.77 . . . . 73.129999999999995 110.625 -175.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -117.05 7.96 13.24 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.54 -0.541 . . . . 73.430000000000007 109.54 174.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -105.38 142.43 35.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.4 -0.818 . . . . 72.430000000000007 110.134 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.443 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -94.94 -24.4 16.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.453 -0.339 . . . . 74.340000000000003 111.63 -175.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.5 t -77.99 -36.37 21.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.142 0.496 . . . . 71.340000000000003 110.137 -176.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.6 tp -61.16 -34.61 75.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.589 -0.732 . . . . 75.310000000000002 110.304 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.74 HD11 ' HG3' ' A' ' 68' ' ' ARG . 87.7 mt -63.26 -35.45 80.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.88 -0.6 . . . . 64.230000000000004 110.885 178.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.0 m -68.29 -27.66 66.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.218 0.532 . . . . 62.32 110.632 178.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.18 -51.11 8.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.852 -0.613 . . . . 54.100000000000001 110.804 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.487 HG12 ' HA ' ' A' ' 35' ' ' LEU . 9.8 p -65.8 -34.26 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.25 -0.432 . . . . 52.119999999999997 110.514 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.21 -48.03 83.0 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 121.08 -0.581 . . . . 63.119999999999997 112.557 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.72 -25.26 67.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.107 0.48 . . . . 72.040000000000006 111.243 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.557 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.4 mt -75.6 -52.37 10.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.055 -0.52 . . . . 73.049999999999997 110.075 177.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.27 -49.15 75.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.748 -0.66 . . . . 74.310000000000002 111.104 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -63.6 -28.17 69.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.396 -0.365 . . . . 65.25 110.803 -178.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -73.44 -18.56 79.41 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.799 -0.715 . . . . 45.340000000000003 112.573 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -114.41 15.43 17.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.707 0.262 . . . . 63.43 111.707 -176.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.9 t70 71.45 7.35 6.01 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.426 0.631 . . . . 73.129999999999995 111.544 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 58.5 mt -70.96 112.09 5.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.169 -0.469 . . . . 74.409999999999997 111.01 -176.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -64.68 130.95 37.22 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.844 -0.616 . . . . 51.219999999999999 112.015 177.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 19.6 p80 -138.41 147.35 43.25 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.708 0.289 . . . . 72.129999999999995 110.769 -177.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 71' ' ' LEU . 77.3 mt -82.8 -65.92 0.95 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.092 -0.503 . . . . 70.430000000000007 110.996 176.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 54.5 t . . . . . 0 N--CA 1.466 0.372 0 CA-C-O 121.875 0.845 . . . . 63.32 110.602 -177.087 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo . . . . . 0 N--CA 1.465 -0.174 0 CA-C-O 120.799 0.25 . . . . 73.450000000000003 111.89 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.74 ' HG3' HD11 ' A' ' 35' ' ' LEU . 13.3 mmt85 -130.02 122.52 28.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.186 -0.301 . . . . 72.400000000000006 110.186 -177.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.721 ' HD3' HD11 ' A' ' 71' ' ' LEU . 1.8 ptp180 -112.66 136.44 52.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.196 0.522 . . . . 74.299999999999997 110.402 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 48.2 t -106.97 111.64 36.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.991 -0.55 . . . . 52.340000000000003 110.162 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.721 HD11 ' HD3' ' A' ' 69' ' ' ARG . 7.6 mp -104.62 139.78 38.97 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.34 -0.391 . . . . 75.409999999999997 110.253 177.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.8 m -130.27 168.68 22.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 O-C-N 123.73 0.644 . . . . 74.450000000000003 110.038 177.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 -82.38 163.22 21.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.292 -0.413 . . . . 63.340000000000003 110.83 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -59.45 -27.07 65.74 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.293 -0.412 . . . . 62.530000000000001 110.169 174.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -43.41 -59.12 2.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.218 -0.901 . . . . 74.5 111.781 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -116.79 35.42 4.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.181 -0.463 . . . . 74.340000000000003 110.31 -175.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.496 ' O ' ' HG3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -59.71 -53.89 52.69 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.363 -0.606 . . . . 73.120000000000005 109.363 178.675 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.48 -30.34 69.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.977 -0.556 . . . . 41.43 110.704 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.87 -49.32 49.36 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.802 -0.635 . . . . 62.32 112.389 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.75 -39.51 93.75 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.387 0.137 . . . . 62.399999999999999 110.71 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 77' ' ' LEU . 73.5 mtp180 -57.66 -47.92 80.94 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 110.088 -0.338 . . . . 72.430000000000007 110.088 175.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 82' ' ' ARG . 3.8 tpp180 -58.12 -50.9 71.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.79 -0.641 . . . . 73.219999999999999 110.494 178.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.557 HD21 ' HB3' ' A' ' 41' ' ' LEU . 55.7 tp -58.35 -52.18 66.69 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.529 -0.76 . . . . 75.209999999999994 111.856 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.98 -33.43 73.68 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.624 0.25 . . . . 73.420000000000002 111.643 -177.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.969 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 53.4 m -73.3 -36.67 66.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.1 0.476 . . . . 45.130000000000003 110.633 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -74.53 -32.79 62.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.83 -0.623 . . . . 71.430000000000007 110.3 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.57 96.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.776 -0.647 . . . . 72.5 111.807 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 150.94 -47.4 0.59 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 119.76 -1.21 . . . . 73.010000000000005 113.622 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.825 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -53.58 -75.77 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.7 0.25 . . . . 74.230000000000004 111.504 -175.014 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.969 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 42.2 38.89 1.24 Allowed 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.573 0.582 . . . . 53.229999999999997 112.573 178.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 29.5 t-80 -132.78 -46.44 0.87 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.385 0.612 . . . . 73.510000000000005 110.375 -176.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -71.09 -13.25 61.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.038 -0.983 . . . . 73.030000000000001 110.892 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.655 ' HA ' ' HB3' ' A' ' 27' ' ' LEU . 6.7 mp -66.13 96.0 0.31 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.881 -0.6 . . . . 72.450000000000003 110.131 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.043 -0.526 . . . . 63.240000000000002 110.577 -172.702 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttt . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.169 0.509 . . . . 71.109999999999999 110.109 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -174.97 54.71 0.13 Allowed Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 110.865 -0.894 . . . . 64.340000000000003 110.865 178.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.4 p -90.77 -4.52 56.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.49 -0.355 . . . . 73.549999999999997 111.888 -173.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.2 p -76.35 71.86 3.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.114 0.483 . . . . 74.310000000000002 112.238 -175.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -163.35 121.22 1.92 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.139 0.495 . . . . 75.299999999999997 111.49 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -118.56 -113.81 0.33 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 107.434 -1.321 . . . . 62.109999999999999 107.434 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 62.91 28.44 16.34 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.174 0.512 . . . . 63.030000000000001 111.815 166.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -114.48 105.39 13.05 Favored 'General case' 0 C--N 1.329 -0.31 0 O-C-N 121.699 -0.626 . . . . 65.349999999999994 111.558 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.4 p80 -160.81 126.63 3.9 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.917 -0.401 . . . . 60.439999999999998 109.917 170.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.4 t-160 -160.31 70.08 0.41 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.226 0.536 . . . . 70.340000000000003 109.689 178.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 p -99.38 101.36 12.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.738 -0.664 . . . . 54.329999999999998 110.607 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.6 m -152.2 86.27 1.29 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.334 -0.394 . . . . 45.210000000000001 110.558 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -132.6 37.27 2.05 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.858 -0.687 . . . . 61.240000000000002 111.938 179.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -101.97 36.0 2.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.082 0.468 . . . . 75.030000000000001 110.218 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 . . . . . 0 C--N 1.324 -0.515 0 CA-C-N 115.754 -0.657 . . . . 70.230000000000004 110.458 179.819 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.468 ' HB3' HD23 ' A' ' 71' ' ' LEU . 95.3 mt . . . . . 0 C--O 1.236 0.382 0 CA-C-O 121.033 0.444 . . . . 51.240000000000002 111.555 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 50.3 mmm-85 -106.09 132.99 51.51 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.722 -0.672 . . . . 74.040000000000006 109.87 177.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.544 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 22.3 tt0 -80.31 110.69 15.99 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.291 -0.633 . . . . 74.200000000000003 109.291 -179.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.671 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -84.62 -55.0 4.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.051 -0.522 . . . . 55.329999999999998 110.667 -172.597 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.782 ' HB3' HD23 ' A' ' 93' ' ' LEU . 1.2 pt? -142.59 153.99 44.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.14 -0.482 . . . . 72.329999999999998 110.689 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 28' ' ' ARG . 4.7 tmm_? -139.98 130.8 25.97 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.324 -0.853 . . . . 71.319999999999993 109.07 -178.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.0 t -167.11 175.5 7.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.118 -0.327 . . . . 60.439999999999998 110.118 178.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -119.53 4.07 11.17 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.368 -0.378 . . . . 64.319999999999993 110.202 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -85.6 108.27 17.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 54.130000000000003 110.353 -178.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.62 -35.91 81.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.728 -0.669 . . . . 75.430000000000007 111.52 -176.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 50.7 t -62.06 -51.95 66.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.911 0.386 . . . . 65.129999999999995 110.437 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.558 HD11 HD13 ' A' ' 89' ' ' LEU . 32.9 tp -64.45 -42.13 96.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.989 -0.55 . . . . 72.219999999999999 110.853 -179.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.404 HD13 ' HD2' ' A' ' 68' ' ' ARG . 62.1 mt -59.35 -38.95 81.69 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.778 0.323 . . . . 60.200000000000003 111.201 178.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 m -66.43 -38.72 88.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.918 0.39 . . . . 74.200000000000003 110.496 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.58 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.29 -46.52 80.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 60.219999999999999 110.288 177.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.555 HG13 HD21 ' A' ' 84' ' ' LEU . 95.5 t -59.59 -43.54 91.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 65.420000000000002 110.751 178.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.22 -43.68 97.01 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.985 -0.626 . . . . 74.219999999999999 111.918 178.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.47 -36.08 82.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.721 0.296 . . . . 50.43 110.886 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 94.2 mt -65.35 -52.29 54.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.004 0.431 . . . . 63.520000000000003 110.395 178.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.0 mt -64.53 -36.73 85.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.808 -0.633 . . . . 75.239999999999995 110.859 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -65.1 -39.96 93.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.029 -0.532 . . . . 72.109999999999999 110.305 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.61 -21.43 74.67 Favored Glycine 0 CA--C 1.518 0.239 0 CA-C-N 115.804 -0.635 . . . . 73.349999999999994 112.876 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -101.63 0.66 36.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.957 0.408 . . . . 65.430000000000007 110.338 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 t70 59.59 30.09 19.7 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.27 -0.877 . . . . 74.219999999999999 111.253 178.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 65.2 mt -79.67 114.83 21.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-N 115.962 -0.563 . . . . 72.319999999999993 110.158 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.21 110.87 2.71 Favored Glycine 0 N--CA 1.453 -0.195 0 CA-C-N 116.06 -0.518 . . . . 60.399999999999999 112.183 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 54.2 p-80 -131.36 137.86 48.92 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.71 0.29 . . . . 73.120000000000005 110.808 -175.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 92.8 mt -112.63 146.55 38.42 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.665 -0.495 . . . . 73.540000000000006 109.665 177.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.441 HG12 ' HA ' ' A' ' 70' ' ' VAL . 16.7 m . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 116.486 -0.325 . . . . 74.109999999999999 110.452 -176.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo . . . . . 0 C--O 1.234 0.32 0 CA-C-O 121.243 0.434 . . . . 52.409999999999997 111.656 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.404 ' HD2' HD13 ' A' ' 35' ' ' LEU . 40.3 ttm180 -105.58 112.48 25.58 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.647 -0.706 . . . . 74.510000000000005 110.212 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.415 ' HG3' ' OE1' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -115.39 158.97 21.7 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.007 -0.542 . . . . 62.509999999999998 109.842 176.799 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.441 ' HA ' HG12 ' A' ' 51' ' ' VAL . 21.4 t -109.24 118.09 55.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.406 -0.361 . . . . 74.239999999999995 110.747 -175.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.544 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.3 mp -107.88 132.49 53.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.206 -0.452 . . . . 71.420000000000002 109.794 177.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.3 m -92.77 142.86 12.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 120.878 0.37 . . . . 43.509999999999998 110.738 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -88.18 61.2 6.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 74.230000000000004 110.477 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 55.85 -169.25 0.09 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.215 -0.902 . . . . 64.439999999999998 112.217 178.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.4 t70 64.32 -72.59 0.06 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.924 0.889 . . . . 65.109999999999999 112.328 177.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.608 ' OD1' ' HA3' ' A' ' 79' ' ' GLY . 0.4 OUTLIER -88.93 36.53 0.81 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.187 0.517 . . . . 73.019999999999996 110.577 -175.473 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.39 -51.18 70.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.617 -0.719 . . . . 75.310000000000002 110.419 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.41 -27.72 62.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.714 -0.675 . . . . 63.32 110.244 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.608 ' HA3' ' OD1' ' A' ' 76' ' ' ASP . . . -61.67 -52.87 47.94 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.649 -0.705 . . . . 60.009999999999998 112.424 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.96 97.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.629 0.252 . . . . 71.439999999999998 111.088 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 81.4 mtp180 -59.16 -41.85 89.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.094 0.473 . . . . 64.209999999999994 110.63 178.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.464 ' HA ' ' HE ' ' A' ' 82' ' ' ARG . 0.3 OUTLIER -68.89 -49.62 56.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.621 -0.718 . . . . 61.119999999999997 110.809 179.545 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 49.6 tp -56.27 -48.99 75.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.519 -0.764 . . . . 74.510000000000005 112.074 -173.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.555 HD21 HG13 ' A' ' 38' ' ' VAL . 11.1 mp -67.66 -27.37 66.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.651 -0.249 . . . . 74.019999999999996 111.211 -178.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.762 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.2 m -70.97 -43.48 67.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.396 -0.365 . . . . 74.239999999999995 110.264 175.114 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -62.77 -39.79 95.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.999 -0.546 . . . . 72.099999999999994 110.764 176.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.86 -43.47 85.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.801 -0.636 . . . . 75.409999999999997 111.465 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 140.08 -43.37 1.14 Allowed Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 119.939 -1.124 . . . . 73.200000000000003 113.433 176.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.873 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -58.93 -75.94 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.654 0.242 . . . . 74.219999999999999 111.654 -175.299 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.873 ' H ' ' HG ' ' A' ' 89' ' ' LEU . . . 44.69 44.46 7.49 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 122.772 0.429 . . . . 54.420000000000002 111.548 -177.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -116.55 -56.02 2.32 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.893 -0.323 . . . . 74.239999999999995 111.467 -173.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -76.81 10.25 2.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.299 -0.41 . . . . 73.120000000000005 111.235 -177.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.782 HD23 ' HB3' ' A' ' 27' ' ' LEU . 63.2 mt -80.52 117.8 21.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.433 . . . . 70.129999999999995 110.273 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 . . . . . 0 C--N 1.319 -0.757 0 N-CA-C 109.226 -0.657 . . . . 73.219999999999999 109.226 177.03 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttp . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.76 0.314 . . . . 62.240000000000002 110.542 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.24 86.59 1.86 Allowed Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.8 -0.714 . . . . 72.099999999999994 111.707 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.1 m -116.06 118.56 33.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.779 0.323 . . . . 51.329999999999998 110.844 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.6 m -104.39 114.07 28.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.638 -0.504 . . . . 43.329999999999998 109.638 176.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -137.84 105.78 5.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.238 0.542 . . . . 73.420000000000002 111.624 -176.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -142.99 95.0 2.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.45 -0.795 . . . . 73.310000000000002 109.802 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -75.14 149.52 39.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.467 -0.788 . . . . 75.519999999999996 110.904 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -167.91 128.94 1.41 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.218 0.532 . . . . 73.310000000000002 111.061 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.5 p-80 -145.22 75.92 1.46 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.795 0.807 . . . . 71.420000000000002 109.754 175.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -81.54 87.59 6.23 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.737 -0.665 . . . . 65.439999999999998 111.571 -171.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.1 m -130.67 123.57 29.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.851 -0.796 . . . . 72.25 108.851 173.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.3 t -135.92 104.31 5.68 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.484 0.55 . . . . 72.409999999999997 112.484 -175.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 72.37 -167.53 53.23 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.285 -0.871 . . . . 75.120000000000005 114.917 167.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -172.99 -176.62 1.44 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.508 -0.846 . . . . 65.530000000000001 108.981 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 . . . . . 0 C--N 1.325 -0.491 0 N-CA-C 110.354 -0.239 . . . . 75.329999999999998 110.354 177.475 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.553 HD22 HD12 ' A' ' 50' ' ' LEU . 5.8 mp . . . . . 0 CA--C 1.519 -0.226 0 N-CA-C 109.85 -0.426 . . . . 75.030000000000001 109.85 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -122.06 169.27 11.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.299 -0.41 . . . . 75.109999999999999 110.218 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -67.89 120.72 14.64 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.28 -0.418 . . . . 63.340000000000003 111.384 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.634 HD12 HD22 ' A' ' 27' ' ' LEU . 1.8 tm? -74.62 -36.41 62.94 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 107.254 -1.388 . . . . 54.310000000000002 107.254 169.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.634 HD22 HD12 ' A' ' 26' ' ' LEU . 2.5 pt? -176.81 159.99 1.84 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.186 -0.915 . . . . 71.540000000000006 110.195 -175.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.447 ' NH1' ' HB3' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -110.07 112.02 23.74 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.081 -1.081 . . . . 74.439999999999998 108.081 170.125 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.686 HG22 ' H ' ' A' ' 32' ' ' ALA . 11.2 m -85.13 109.22 18.11 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.104 -0.498 . . . . 73.310000000000002 111.237 -171.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.447 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.6 OUTLIER -90.51 -15.04 31.49 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.125 -0.694 . . . . 74.340000000000003 109.125 176.569 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -73.14 -32.48 64.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.12 -0.945 . . . . 71.430000000000007 110.873 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.686 ' H ' HG22 ' A' ' 29' ' ' THR . . . 74.25 -40.27 0.45 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.703 0.801 . . . . 73.299999999999997 112.586 178.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.1 t -78.91 -39.99 22.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.051 0.453 . . . . 75.319999999999993 110.805 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.404 ' O ' HG23 ' A' ' 38' ' ' VAL . 55.5 tp -52.79 -39.84 62.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.681 -0.691 . . . . 63.119999999999997 112.266 -178.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 4.5 pp -65.23 -25.2 67.58 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 111.651 0.241 . . . . 73.019999999999996 111.651 -175.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.1 m -70.67 -34.03 71.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.099 0.476 . . . . 74.040000000000006 109.958 178.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.33 -40.91 50.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.974 -0.557 . . . . 73.25 110.044 176.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.425 HG13 HD21 ' A' ' 84' ' ' LEU . 75.1 t -57.24 -36.34 51.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 115.606 -0.725 . . . . 73.140000000000001 110.799 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.99 -46.03 95.41 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.596 -0.729 . . . . 70.439999999999998 112.433 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.34 -26.6 65.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.913 0.387 . . . . 62.200000000000003 111.201 -179.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.32 -52.12 13.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.395 -0.366 . . . . 74.230000000000004 110.977 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.539 HD23 HD23 ' A' ' 83' ' ' LEU . 63.7 mt -69.45 -39.45 77.76 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.218 -0.446 . . . . 75.239999999999995 111.401 -175.053 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -30.54 60.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.586 -0.279 . . . . 60.219999999999999 111.117 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.51 -26.67 73.6 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.038 -0.601 . . . . 63.009999999999998 111.796 177.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.45 5.58 46.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.597 0.237 . . . . 53.210000000000001 110.876 178.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.1 t70 70.61 7.68 6.3 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.84 -0.618 . . . . 74.030000000000001 111.217 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.0 mt -75.2 -45.36 41.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.254 0.549 . . . . 63.119999999999997 110.696 -178.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.01 148.21 23.86 Favored Glycine 0 C--N 1.315 -0.588 0 CA-C-N 115.285 -0.871 . . . . 50.229999999999997 111.854 -179.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -142.66 139.78 31.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.291 -0.263 . . . . 70.530000000000001 110.291 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.553 HD12 HD22 ' A' ' 23' ' ' LEU . 71.0 mt -119.02 106.73 12.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.826 0.346 . . . . 72.409999999999997 110.469 175.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.599 HG22 HG22 ' A' ' 70' ' ' VAL . 59.0 t . . . . . 0 C--N 1.325 -0.498 0 N-CA-C 109.046 -0.724 . . . . 75.349999999999994 109.046 174.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo . . . . . 0 N--CA 1.46 -0.448 0 CA-C-O 121.194 0.414 . . . . 75.340000000000003 111.464 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -72.58 133.55 44.77 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.707 -0.679 . . . . 64.109999999999999 110.223 -177.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 57.2 mtt85 -113.97 135.1 54.37 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.999 -0.546 . . . . 72.329999999999998 111.765 -171.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.599 HG22 HG22 ' A' ' 51' ' ' VAL . 45.0 t -101.98 116.55 45.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.913 -0.585 . . . . 73.209999999999994 109.666 177.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mp -101.95 142.98 32.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.793 0.33 . . . . 53.340000000000003 110.546 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.447 HG23 ' HB2' ' A' ' 26' ' ' LEU . 3.0 t -126.29 154.25 35.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.9 -0.591 . . . . 45.109999999999999 109.882 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -59.14 139.06 57.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.99 -0.55 . . . . 73.540000000000006 109.637 174.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.411 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 38.1 mt-10 -57.53 156.43 8.16 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.969 -0.292 . . . . 71.129999999999995 110.387 178.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.411 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 28.7 t70 73.05 -47.5 0.67 Allowed 'General case' 0 N--CA 1.468 0.471 0 O-C-N 123.935 0.772 . . . . 54.530000000000001 110.376 -173.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -73.85 -16.13 61.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.787 -0.82 . . . . 64.439999999999998 108.787 175.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.425 HD22 HD23 ' A' ' 26' ' ' LEU . 1.1 tm? -55.57 -45.83 77.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.524 -1.216 . . . . 72.209999999999994 109.659 174.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.06 -38.16 89.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 71.329999999999998 110.987 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.62 -44.41 82.13 Favored Glycine 0 C--N 1.329 0.181 0 C-N-CA 120.971 -0.633 . . . . 61.43 111.829 177.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.408 ' O ' ' HG ' ' A' ' 84' ' ' LEU . . . -59.54 -39.78 85.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.77 0.319 . . . . 14.43 110.683 177.281 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.4 mtp180 -55.35 -52.91 61.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.89 -0.596 . . . . 75.329999999999998 110.947 176.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -62.3 -43.49 98.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 75.329999999999998 110.754 -177.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.539 HD23 HD23 ' A' ' 42' ' ' LEU . 50.1 tp -59.28 -47.11 86.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.641 -0.708 . . . . 74.450000000000003 111.035 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.425 HD21 HG13 ' A' ' 38' ' ' VAL . 66.4 mt -72.01 -26.11 62.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.073 -0.512 . . . . 75.340000000000003 111.588 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 56.4 m -68.0 -48.3 66.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.584 -0.28 . . . . 75.040000000000006 110.423 176.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -65.64 -42.09 91.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.86 0.362 . . . . 73.439999999999998 110.698 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -119.42 82.21 1.84 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.099 0.476 . . . . 71.329999999999998 111.136 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 154.3 -95.69 0.15 Allowed Glycine 0 N--CA 1.44 -1.091 0 N-CA-C 111.384 -0.686 . . . . 34.130000000000003 111.384 178.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.559 HD12 ' N ' ' A' ' 90' ' ' ALA . 1.7 pp 175.12 -35.28 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.763 0.425 . . . . 62.520000000000003 110.662 -177.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ALA . . . . . 0.559 ' N ' HD12 ' A' ' 89' ' ' LEU . . . 48.39 54.12 10.9 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.707 -0.679 . . . . 61.299999999999997 112.185 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -99.8 -34.64 10.07 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.642 0.258 . . . . 74.150000000000006 110.879 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -82.09 24.44 0.65 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.344 -0.389 . . . . 64.549999999999997 111.786 -175.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.405 HD21 ' HB1' ' A' ' 90' ' ' ALA . 94.2 mt -50.09 117.51 2.38 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.372 0.42 . . . . 71.310000000000002 111.83 -175.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.409 ' N ' ' HA ' ' A' ' 27' ' ' LEU . 79.2 mtt180 . . . . . 0 N--CA 1.466 0.346 0 O-C-N 124.048 0.842 . . . . 74.329999999999998 110.947 -172.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.0 mtp . . . . . 0 N--CA 1.478 0.968 0 CA-C-O 120.714 0.293 . . . . 72.530000000000001 110.531 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 117.64 90.02 1.42 Allowed Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.821 -0.704 . . . . 50.350000000000001 111.968 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.6 p -66.61 158.08 30.81 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.884 0.374 . . . . 75.530000000000001 110.78 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 m -76.2 97.49 4.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.936 0.398 . . . . 74.319999999999993 110.722 -177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -90.33 93.64 9.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 53.530000000000001 109.899 179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -123.02 99.27 6.29 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.181 -0.463 . . . . 72.510000000000005 110.11 -176.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 74.9 m-70 -110.49 169.41 8.76 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.067 -0.716 . . . . 73.420000000000002 109.067 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.5 p-80 -153.56 130.83 11.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.262 0.554 . . . . 73.25 111.097 178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.7 t-80 -142.99 113.12 7.17 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.445 -0.798 . . . . 45.32 109.101 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -103.68 112.03 24.78 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.035 0.445 . . . . 73.310000000000002 110.652 -174.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.1 m -150.65 117.94 6.02 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.714 -0.676 . . . . 62.530000000000001 110.406 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.0 t -134.68 88.7 2.46 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.078 -0.51 . . . . 64.439999999999998 109.928 178.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -131.67 58.0 0.71 Allowed Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 111.373 -0.691 . . . . 40.310000000000002 111.373 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -87.89 76.3 8.71 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.638 -0.504 . . . . 71.299999999999997 109.638 -176.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -97.66 -11.3 23.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.89 -0.595 . . . . 74.099999999999994 110.736 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -71.58 104.78 3.41 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.553 -0.536 . . . . 71.409999999999997 109.553 175.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 83.4 mt -100.19 1.51 42.04 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.132 -0.486 . . . . 75.340000000000003 111.246 -175.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.406 ' O ' ' HB2' ' A' ' 19' ' ' PHE . 47.2 m-85 -129.39 -159.69 0.98 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.557 0.217 . . . . 64.230000000000004 110.759 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.406 ' HB2' ' O ' ' A' ' 18' ' ' TYR . 66.6 m-85 73.97 75.88 0.12 Allowed 'General case' 0 C--O 1.234 0.286 0 O-C-N 124.055 0.847 . . . . 75.430000000000007 111.84 176.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -91.91 93.5 8.83 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.448 -0.796 . . . . 64.430000000000007 109.666 171.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -176.75 -134.87 2.05 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 110.891 -0.883 . . . . 51.420000000000002 110.891 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER 177.67 -51.24 0.01 OUTLIER 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.848 0.324 . . . . 70.349999999999994 111.18 178.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 95.7 mt -134.82 143.38 47.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.028 0.442 . . . . 65.209999999999994 111.649 -175.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.891 ' HB2' HD21 ' A' ' 77' ' ' LEU . 50.7 mtt180 -134.4 148.03 50.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.974 -0.557 . . . . 72.439999999999998 109.729 173.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.84 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 25.1 tt0 -81.94 136.58 35.29 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.038 -0.528 . . . . 70.109999999999999 110.701 -177.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.676 HD11 HG22 ' A' ' 72' ' ' VAL . 11.2 mp -106.77 -65.86 1.06 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.634 0.254 . . . . 63.329999999999998 111.521 -179.12 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -147.0 177.21 9.32 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.733 0.301 . . . . 74.140000000000001 110.925 -177.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' HB ' ' A' ' 29' ' ' THR . 6.2 ptp180 -148.46 154.28 39.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.319 -0.4 . . . . 73.109999999999999 110.223 -178.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.461 HG21 HD23 ' A' ' 34' ' ' LEU . 12.2 t 178.29 163.61 0.7 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.377 0.423 . . . . 74.239999999999995 110.121 176.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -113.95 -0.17 14.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.009 0.433 . . . . 74.430000000000007 109.834 175.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -73.77 116.51 14.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.755 -0.657 . . . . 72.129999999999995 110.576 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.56 -33.8 74.48 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.55 -0.75 . . . . 54.210000000000001 112.239 -176.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 65.7 t -72.34 -47.53 52.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.818 0.342 . . . . 72.049999999999997 110.25 -178.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.461 HD23 HG21 ' A' ' 29' ' ' THR . 40.2 tp -61.38 -40.83 95.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 75.129999999999995 110.426 178.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.581 HD13 ' HD2' ' A' ' 68' ' ' ARG . 69.9 mt -65.26 -29.17 69.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.959 -0.564 . . . . 72.549999999999997 111.356 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.1 m -76.05 -39.08 56.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.715 0.293 . . . . 62.530000000000001 110.528 177.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.457 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -64.43 -53.89 41.33 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.194 -0.457 . . . . 70.219999999999999 110.935 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.8 t -60.53 -38.25 77.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.066 -0.515 . . . . 63.5 110.884 179.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.55 -48.39 82.14 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.897 -0.592 . . . . 70.299999999999997 111.918 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.63 -34.66 77.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.714 0.293 . . . . 62.109999999999999 111.629 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 96.2 mt -64.6 -51.48 62.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.14 -0.482 . . . . 75.030000000000001 110.639 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 83.4 mt -70.13 -41.36 74.02 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.93 -0.577 . . . . 74.109999999999999 110.984 -177.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -65.74 -39.44 91.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.899 -0.591 . . . . 74.120000000000005 110.821 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.0 -25.04 71.95 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 121.122 -0.561 . . . . 72.109999999999999 112.822 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -102.05 7.98 41.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.542 0.211 . . . . 70.129999999999995 111.412 -179.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.8 t70 61.41 30.55 18.98 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.539 0.685 . . . . 74.140000000000001 110.903 177.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.59 HG21 ' HB2' ' A' ' 80' ' ' ALA . 72.0 mt -85.13 121.18 36.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.298 -0.41 . . . . 62.0 110.347 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -62.63 107.98 1.89 Allowed Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.5 -0.64 . . . . 64.400000000000006 111.5 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' VAL . 52.1 p-80 -126.72 166.65 16.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.91 0.386 . . . . 61.310000000000002 111.48 -173.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.5 tp -138.58 104.61 5.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.347 -0.842 . . . . 71.120000000000005 109.676 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.595 HG12 HG22 ' A' ' 70' ' ' VAL . 29.5 m -110.89 2.35 8.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.506 0.669 . . . . 62.140000000000001 110.141 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 32.2 tp -97.15 82.36 3.17 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.174 -0.921 . . . . 73.219999999999999 110.732 -173.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.489 ' HB2' ' HG2' ' A' ' 69' ' ' ARG . 34.8 t70 -82.6 -65.83 0.96 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.38 -0.97 . . . . 62.450000000000003 108.38 172.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -139.3 150.0 44.9 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.227 -1.027 . . . . 73.349999999999994 108.227 167.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -130.58 118.89 21.7 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.199 0.523 . . . . 72.299999999999997 111.088 -179.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.465 ' HB2' HG13 ' A' ' 66' ' ' ILE . 28.0 ttt -76.41 147.28 38.1 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.624 -0.716 . . . . 63.310000000000002 109.61 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.8 m -60.55 151.79 27.78 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.996 0.427 . . . . 71.099999999999994 111.321 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.433 ' O ' HG13 ' A' ' 58' ' ' ILE . 11.2 tp -75.05 3.77 1.1 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-N 115.885 -0.598 . . . . 74.299999999999997 111.744 -173.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -81.31 84.08 6.72 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.053 -0.721 . . . . 73.310000000000002 109.053 177.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 50.58 93.56 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.808 0.843 . . . . 65.230000000000004 112.099 179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -66.52 160.62 46.79 Favored Glycine 0 N--CA 1.452 -0.289 0 CA-C-N 115.681 -0.691 . . . . 73.030000000000001 112.958 -177.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.7 p -80.95 -174.72 4.99 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.971 0.415 . . . . 71.420000000000002 111.153 -179.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.62 -38.02 15.16 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.37 -0.377 . . . . 55.329999999999998 110.69 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -169.92 43.42 0.2 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 119.951 -1.119 . . . . 52.109999999999999 113.126 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 97.4 t -89.44 -34.87 7.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.236 0.541 . . . . 44.310000000000002 110.697 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.465 HG13 ' HB2' ' A' ' 56' ' ' MET . 50.2 mm -117.85 98.27 51.46 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-N 115.976 -0.556 . . . . 71.219999999999999 111.023 -177.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -91.99 140.66 2.34 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 123.172 2.581 . . . . 71.239999999999995 112.08 176.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.581 ' HD2' HD13 ' A' ' 35' ' ' LEU . 66.3 mtt180 -104.39 160.61 14.77 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.121 -0.326 . . . . 71.439999999999998 110.121 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.489 ' HG2' ' HB2' ' A' ' 53' ' ' ASP . 17.8 ptt180 -133.68 140.8 47.27 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.64 -0.504 . . . . 72.129999999999995 109.64 176.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.595 HG22 HG12 ' A' ' 51' ' ' VAL . 48.5 t -103.63 116.38 47.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.907 -0.588 . . . . 60.0 111.253 -173.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.84 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.4 mp -117.84 162.14 18.59 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.107 -0.701 . . . . 75.019999999999996 109.107 173.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.676 HG22 HD11 ' A' ' 26' ' ' LEU . 35.2 m -137.34 167.41 23.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-O 120.824 0.345 . . . . 53.140000000000001 110.104 174.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -73.13 137.55 45.24 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.223 -0.658 . . . . 63.219999999999999 109.223 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.816 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 40.9 mt-10 -65.26 -11.15 38.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.657 0.265 . . . . 72.200000000000003 111.584 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -55.59 -39.25 70.47 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.605 0.717 . . . . 75.200000000000003 110.009 171.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -129.43 33.81 4.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.338 -0.846 . . . . 70.129999999999995 110.215 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.891 HD21 ' HB2' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -56.52 -57.08 13.9 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.656 -0.702 . . . . 64.129999999999995 110.415 -177.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.49 70.36 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.841 -0.618 . . . . 61.25 110.996 179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -68.97 -46.77 58.24 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 121.183 -0.532 . . . . 73.140000000000001 112.659 -178.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.59 ' HB2' HG21 ' A' ' 47' ' ' ILE . . . -63.58 -44.4 94.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.739 0.304 . . . . 63.530000000000001 110.862 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 57.2 mtp85 -67.39 -33.32 74.95 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.031 0.443 . . . . 73.230000000000004 110.401 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -62.01 -47.29 85.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.829 -0.623 . . . . 73.329999999999998 109.788 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.5 tp -60.37 -53.19 60.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 75.329999999999998 110.981 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 90.0 mt -60.47 -28.81 68.62 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.12 -0.491 . . . . 62.219999999999999 112.001 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.768 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 47.4 m -85.26 -48.66 8.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.812 0.339 . . . . 71.349999999999994 111.213 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -74.19 -43.88 55.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.223 -0.444 . . . . 72.230000000000004 111.9 -173.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.54 29.99 4.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.853 0.359 . . . . 64.129999999999995 111.662 -174.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -121.35 -80.0 0.56 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.182 -1.009 . . . . 65.540000000000006 112.306 179.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.47 HD12 ' N ' ' A' ' 90' ' ' ALA . 1.8 pp -167.58 -44.5 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.873 -0.163 . . . . 75.319999999999993 111.273 -177.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.768 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 55.96 94.67 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 O-C-N 123.724 0.64 . . . . 70.239999999999995 111.704 -178.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -157.64 -64.96 0.09 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.523 -0.471 . . . . 72.120000000000005 111.234 -177.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -87.52 16.87 5.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.211 -0.45 . . . . 74.450000000000003 111.824 -172.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 98.8 mt -73.72 126.17 29.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.131 0.491 . . . . 71.530000000000001 111.615 -175.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 25.0 tpt180 -117.02 166.64 11.96 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.468 -0.787 . . . . 61.030000000000001 109.152 178.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 5.7 p -106.82 175.16 5.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.551 0.215 . . . . 73.239999999999995 111.167 -177.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -83.92 72.5 10.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 122.112 0.958 . . . . 54.32 109.265 171.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 0.99 0 CA-C-N 114.918 -1.037 . . . . 51.149999999999999 111.281 -175.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.7 ttp . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 110.176 -0.305 . . . . 74.450000000000003 110.176 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.62 119.24 2.63 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.684 -0.769 . . . . 63.399999999999999 111.993 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.3 t -139.12 97.81 3.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.155 0.502 . . . . 72.25 109.693 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 t -89.78 85.47 6.42 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.331 -0.618 . . . . 52.43 109.331 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -131.51 70.77 1.46 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.558 0.694 . . . . 74.420000000000002 110.291 -177.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -125.93 87.54 2.7 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.641 0.734 . . . . 70.310000000000002 110.828 -178.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.6 p-80 -126.03 37.91 4.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.754 -0.657 . . . . 75.319999999999993 109.848 176.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -70.91 77.94 0.64 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.7 -0.852 . . . . 73.219999999999999 108.7 175.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 37.7 t-80 -122.19 107.85 12.63 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.408 -0.814 . . . . 71.5 109.694 -173.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -130.28 95.43 3.9 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.561 -0.533 . . . . 62.450000000000003 109.561 -177.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.6 t -129.49 113.97 15.54 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.169 -0.469 . . . . 62.130000000000003 109.775 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.2 t -151.3 112.19 4.27 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.183 -0.462 . . . . 61.329999999999998 110.266 178.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 84.38 65.26 1.53 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.908 -0.663 . . . . 63.43 112.7 177.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.42 ' HD2' ' OD1' ' A' ' 76' ' ' ASP . 51.2 ttp85 -77.25 94.91 4.21 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.869 -0.789 . . . . 74.299999999999997 108.869 177.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -84.86 95.32 8.97 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.214 -0.448 . . . . 72.329999999999998 112.021 -171.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.2 p30 176.47 143.47 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.073 -0.967 . . . . 63.43 109.437 171.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 95.8 mt -124.96 22.08 8.08 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.883 0.373 . . . . 55.43 110.501 178.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.646 ' O ' ' HA ' ' A' ' 75' ' ' ASP . 60.5 m-85 -91.77 149.47 21.59 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.951 -0.568 . . . . 43.549999999999997 111.398 -177.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.2 p90 -176.31 156.09 1.56 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.576 -0.898 . . . . 55.329999999999998 108.576 176.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -171.92 -65.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.046 0.388 . . . . 71.219999999999999 112.046 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.46 -114.56 1.45 Allowed Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.821 -0.704 . . . . 74.209999999999994 113.754 -168.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 69.6 m80 -141.66 -77.28 0.28 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.062 0.458 . . . . 75.310000000000002 110.672 -173.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.627 HD13 HD22 ' A' ' 50' ' ' LEU . 14.1 mt -151.86 132.26 13.76 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 73.299999999999997 110.084 -176.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.623 ' HB2' HD21 ' A' ' 77' ' ' LEU . 17.5 mmt180 -113.84 133.38 55.45 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.228 -0.442 . . . . 73.439999999999998 110.419 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.663 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 29.6 tt0 -64.83 109.06 1.94 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.721 -0.844 . . . . 71.030000000000001 108.721 175.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 32.7 tp -87.16 -54.81 4.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.425 -0.352 . . . . 74.099999999999994 110.811 -172.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.58 157.06 43.21 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.282 -0.417 . . . . 73.109999999999999 110.102 177.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.428 ' HG3' ' HB3' ' A' ' 69' ' ' ARG . 39.9 ttp180 -142.73 119.95 11.51 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.628 -0.508 . . . . 72.400000000000006 109.628 179.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -148.91 160.55 43.16 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.107 -0.331 . . . . 64.109999999999999 110.107 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -107.56 10.28 29.26 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.395 -0.366 . . . . 71.349999999999994 110.531 -179.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -92.51 107.51 19.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.382 -0.372 . . . . 72.150000000000006 110.066 177.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.98 -27.15 68.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.953 -0.567 . . . . 72.219999999999999 111.896 -175.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 44.2 t -66.85 -50.91 60.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.861 0.362 . . . . 73.340000000000003 110.477 -179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.716 HD11 HD22 ' A' ' 89' ' ' LEU . 23.1 tp -64.27 -38.68 91.91 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.979 -0.555 . . . . 63.509999999999998 110.323 178.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.458 HD13 ' HD2' ' A' ' 68' ' ' ARG . 77.7 mt -61.25 -32.9 72.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.96 -0.564 . . . . 62.039999999999999 111.047 177.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -70.02 -39.27 75.92 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.905 0.383 . . . . 61.119999999999997 110.559 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.508 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.19 -52.8 52.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 73.129999999999995 110.459 178.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.522 HG13 HD21 ' A' ' 84' ' ' LEU . 86.3 t -60.12 -40.36 83.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.895 -0.593 . . . . 72.010000000000005 110.428 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 43' ' ' ASP . . . -61.7 -49.32 77.56 Favored Glycine 0 N--CA 1.447 -0.625 0 CA-C-N 115.601 -0.727 . . . . 54.149999999999999 112.264 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.37 -31.53 72.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.699 0.285 . . . . 73.120000000000005 111.295 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.701 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.7 mt -64.61 -51.75 61.03 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.219 -0.446 . . . . 74.400000000000006 110.702 178.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.1 mt -71.94 -40.05 68.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.104 -0.498 . . . . 45.420000000000002 110.832 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 39' ' ' GLY . 0.8 OUTLIER -66.5 -35.98 81.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.125 0.488 . . . . 71.219999999999999 110.35 -177.379 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -73.14 -35.51 57.24 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.855 -0.688 . . . . 63.109999999999999 112.378 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.15 -1.0 57.02 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 111.501 0.185 . . . . 73.340000000000003 111.501 -178.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.4 t70 71.24 28.16 3.07 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 123.753 0.658 . . . . 55.530000000000001 110.857 177.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.0 mt -84.02 128.31 38.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.167 -0.47 . . . . 73.439999999999998 110.193 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.81 110.82 3.7 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 121.064 -0.588 . . . . 65.239999999999995 111.978 -177.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -109.21 130.85 55.48 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.013 0.435 . . . . 74.140000000000001 111.436 -177.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.627 HD22 HD13 ' A' ' 23' ' ' LEU . 60.8 tp -98.39 102.8 14.65 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.89 -0.782 . . . . 75.439999999999998 108.89 171.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.451 HG12 HG22 ' A' ' 70' ' ' VAL . 6.4 m -127.23 162.0 33.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.127 -0.488 . . . . 74.400000000000006 110.553 -175.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.9 tt 68.06 102.05 0.05 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 124.122 0.889 . . . . 72.219999999999999 110.311 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -111.98 92.05 3.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.022 -0.536 . . . . 75.150000000000006 110.856 -177.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -177.02 169.01 2.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.483 -0.781 . . . . 75.519999999999996 109.604 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -98.77 132.48 44.1 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.636 -0.257 . . . . 62.219999999999999 110.356 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 22.1 mmt -67.57 104.48 1.6 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.23 0.538 . . . . 72.239999999999995 110.852 178.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 42.8 t -123.48 162.98 21.78 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.615 -0.72 . . . . 72.329999999999998 109.985 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.4 tp -76.66 -18.54 14.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.419 0.628 . . . . 63.450000000000003 109.454 176.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.442 HD22 ' HA ' ' A' ' 59' ' ' LEU . 1.6 tm? -75.27 106.78 6.97 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.638 -0.875 . . . . 70.150000000000006 108.638 176.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -56.86 -50.15 73.31 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.937 -0.574 . . . . 73.420000000000002 111.01 -175.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 173.97 155.8 12.55 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 121.026 -0.607 . . . . 73.230000000000004 111.894 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.7 p -113.64 -39.73 3.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.759 0.314 . . . . 62.439999999999998 110.173 177.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 56.5 tp -173.09 119.64 0.34 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.075 -0.511 . . . . 72.319999999999993 110.081 177.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 146.09 166.49 12.07 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.677 -0.773 . . . . 43.340000000000003 112.383 176.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 37.7 t -109.93 -26.42 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 109.717 -0.475 . . . . 72.209999999999994 109.717 177.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 47.9 mm 69.09 91.03 0.08 OUTLIER Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 115.106 -0.952 . . . . 53.109999999999999 110.633 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -69.24 99.98 0.73 Allowed 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 122.731 2.287 . . . . 70.109999999999999 111.092 178.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.458 ' HD2' HD13 ' A' ' 35' ' ' LEU . 27.7 ttm180 -66.8 122.69 18.24 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.036 -0.529 . . . . 73.25 110.289 -177.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.428 ' HB3' ' HG3' ' A' ' 28' ' ' ARG . 19.3 ptt180 -113.27 152.12 30.23 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.727 -0.669 . . . . 75.450000000000003 110.449 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.451 HG22 HG12 ' A' ' 51' ' ' VAL . 29.8 t -112.98 117.51 55.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.683 -0.689 . . . . 74.209999999999994 110.104 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.663 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 7.5 mp -107.86 137.7 45.4 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.013 -0.365 . . . . 71.150000000000006 110.013 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.487 HG23 HD22 ' A' ' 77' ' ' LEU . 14.5 m -132.39 166.07 30.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.143 -0.48 . . . . 61.109999999999999 110.338 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -76.07 156.56 33.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.434 -0.348 . . . . 74.010000000000005 110.451 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.638 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 57.7 mp0 -59.97 -21.89 61.8 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.324 -0.398 . . . . 73.450000000000003 110.908 174.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.646 ' HA ' ' O ' ' A' ' 18' ' ' TYR . 1.4 m-20 -52.19 -71.41 0.07 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.854 -0.612 . . . . 74.400000000000006 110.737 176.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.42 ' OD1' ' HD2' ' A' ' 14' ' ' ARG . 44.5 m-20 -91.38 18.0 7.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.657 -0.701 . . . . 64.329999999999998 110.653 -177.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.638 ' HB2' ' HA ' ' A' ' 74' ' ' GLU . 0.3 OUTLIER -56.87 -51.18 70.07 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.559 -0.534 . . . . 70.510000000000005 109.559 179.242 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.59 -32.48 72.4 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.602 -0.727 . . . . 62.130000000000003 110.991 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -71.42 -45.96 43.94 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.069 -0.586 . . . . 74.430000000000007 112.334 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.6 -40.21 95.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.59 0.233 . . . . 54.240000000000002 110.558 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -59.13 -45.03 91.99 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.847 0.356 . . . . 62.509999999999998 110.132 175.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.47 -50.9 72.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.779 -0.646 . . . . 74.099999999999994 110.553 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.701 HD21 ' HB3' ' A' ' 41' ' ' LEU . 55.8 tp -58.61 -52.96 63.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.772 -0.649 . . . . 71.230000000000004 111.257 -177.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.522 HD21 HG13 ' A' ' 38' ' ' VAL . 85.6 mt -66.54 -28.26 68.4 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.226 -0.443 . . . . 72.319999999999993 111.944 -177.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.863 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 90.6 m -82.45 -50.18 9.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.826 0.346 . . . . 64.450000000000003 111.14 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -72.93 -44.13 61.56 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.338 0.495 . . . . 75.310000000000002 112.338 -173.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -121.76 7.26 9.93 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.827 0.677 . . . . 73.209999999999994 112.827 -172.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -111.41 -74.96 0.76 Allowed Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 119.915 -1.136 . . . . 71.310000000000002 112.288 -178.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.716 HD22 HD11 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -172.61 -51.89 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.526 0.203 . . . . 74.299999999999997 111.203 -172.357 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.863 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 59.2 82.98 0.14 Allowed 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.905 -0.589 . . . . 54.43 110.74 -172.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 40.1 t60 -158.79 -44.59 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.03 0.443 . . . . 74.109999999999999 110.796 -176.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -89.91 11.11 21.35 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.071 -0.513 . . . . 71.120000000000005 110.819 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 90.9 mt -71.17 133.0 45.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 63.109999999999999 110.911 -176.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 95' ' ' SER . 3.4 tpt180 -116.79 -60.36 1.86 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.798 -0.637 . . . . 73.510000000000005 110.679 178.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.441 ' O ' ' HG3' ' A' ' 94' ' ' ARG . 19.4 m 64.3 -167.19 0.22 Allowed 'General case' 0 CA--C 1.535 0.387 0 O-C-N 123.372 0.42 . . . . 51.229999999999997 110.287 -176.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 97' ' ' ASP . 15.4 p-10 -73.6 -53.08 11.33 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 109.594 -0.521 . . . . 74.349999999999994 109.594 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.429 ' HB2' ' O ' ' A' ' 96' ' ' ASP . 19.0 t70 . . . . . 0 C--O 1.251 1.157 0 O-C-N 124.131 0.894 . . . . 74.140000000000001 109.09 171.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.4 mtt . . . . . 0 N--CA 1.482 1.128 0 CA-C-O 120.835 0.35 . . . . 53.109999999999999 110.207 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 81.3 -172.4 53.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.751 -0.738 . . . . 52.420000000000002 111.783 -177.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.0 p -141.08 148.28 39.92 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.005 0.402 . . . . 72.439999999999998 110.784 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.2 p -87.0 133.19 33.6 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.041 -0.527 . . . . 71.120000000000005 110.563 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.7 p80 -124.34 116.26 22.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.512 0.672 . . . . 71.540000000000006 111.231 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -145.33 106.57 4.19 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.289 -0.869 . . . . 63.549999999999997 109.715 175.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -127.75 107.25 9.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.488 -0.324 . . . . 73.230000000000004 111.26 -176.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -144.27 146.45 32.64 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.401 -0.592 . . . . 71.010000000000005 109.401 172.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -156.02 118.42 4.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.131 0.491 . . . . 73.450000000000003 111.673 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -145.45 94.17 2.47 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.74 0.781 . . . . 62.399999999999999 109.923 168.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.1 t -130.65 102.18 6.01 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.356 -0.838 . . . . 64.219999999999999 109.493 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.7 t -149.35 155.34 40.35 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.485 -0.561 . . . . 64.230000000000004 109.485 -176.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 158.97 99.1 0.15 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.909 -0.663 . . . . 74.030000000000001 111.881 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -95.24 -26.91 15.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.917 0.389 . . . . 75.019999999999996 110.487 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -85.02 96.01 9.27 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.222 0.534 . . . . 72.239999999999995 110.326 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -144.14 168.78 19.22 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.178 -0.919 . . . . 73.450000000000003 108.951 -179.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 94.8 mt -111.85 108.95 18.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.885 0.374 . . . . 63.020000000000003 110.885 -179.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -87.25 -28.52 22.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.268 -0.423 . . . . 72.010000000000005 110.284 175.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -69.09 157.8 36.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.026 -0.534 . . . . 65.540000000000006 110.96 -177.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -123.98 124.88 43.55 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.316 -0.402 . . . . 74.200000000000003 110.718 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -118.59 -167.6 13.97 Favored Glycine 0 N--CA 1.449 -0.489 0 N-CA-C 111.57 -0.612 . . . . 54.530000000000001 111.57 176.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.447 ' O ' ' HB2' ' A' ' 74' ' ' GLU . 52.5 m80 -135.32 178.11 7.29 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.993 -0.373 . . . . 73.040000000000006 109.993 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 73' ' ' HIS . 8.5 mp -80.62 129.28 34.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.057 -0.72 . . . . 62.509999999999998 109.057 174.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 77.9 mtt180 -105.3 142.52 34.93 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.407 -0.361 . . . . 73.140000000000001 110.229 -177.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.785 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 28.9 tt0 -76.12 109.07 9.48 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.472 -0.936 . . . . 75.329999999999998 108.472 176.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.422 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -81.82 -70.17 0.56 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.131 -0.486 . . . . 75.400000000000006 112.04 -169.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.499 ' HB2' ' O ' ' A' ' 92' ' ' GLU . 0.9 OUTLIER -142.38 170.28 15.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.192 0.52 . . . . 74.340000000000003 112.225 -169.645 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.564 ' O ' ' HB3' ' A' ' 92' ' ' GLU . 6.4 ptp180 -138.34 158.04 45.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.881 -1.054 . . . . 73.530000000000001 109.0 177.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.8 t -161.21 163.03 31.4 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.05 -0.352 . . . . 62.32 110.05 174.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -116.02 11.41 15.36 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.141 -0.481 . . . . 75.129999999999995 110.363 -174.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.401 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . 28.4 t70 -120.41 135.51 55.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.168 -0.469 . . . . 72.109999999999999 111.223 -177.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -73.21 -31.78 64.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.82 -0.627 . . . . 65.430000000000007 111.522 -176.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.4 t -69.87 -43.43 79.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 109.621 -0.511 . . . . 71.450000000000003 109.621 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.401 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 9.2 mp -58.84 -48.35 81.65 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.571 -0.741 . . . . 72.109999999999999 110.846 175.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 36.6 mt -52.79 -41.72 64.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.929 -0.578 . . . . 75.299999999999997 111.381 175.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.9 m -72.71 -41.63 65.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.226 -0.443 . . . . 65.409999999999997 111.092 -178.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.489 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -64.05 -54.22 37.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.481 -0.327 . . . . 51.119999999999997 110.649 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.696 HG13 HD22 ' A' ' 84' ' ' LEU . 87.8 t -61.02 -40.46 85.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.147 0.499 . . . . 75.319999999999993 110.607 178.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.17 -52.04 50.43 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-N 115.702 -0.681 . . . . 71.019999999999996 112.528 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.33 -31.8 67.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.671 0.272 . . . . 61.219999999999999 111.485 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 94.2 mt -63.15 -51.24 67.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.334 -0.394 . . . . 61.350000000000001 110.341 177.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.4 mt -68.25 -36.8 80.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.836 -0.62 . . . . 73.439999999999998 110.652 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -64.4 -46.84 81.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 71.010000000000005 110.53 177.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.47 -36.97 93.25 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.794 -0.639 . . . . 62.509999999999998 112.93 -179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -73.97 -10.72 59.93 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.012 0.434 . . . . 74.519999999999996 110.81 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.4 t70 70.32 23.71 4.96 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 115.061 -0.972 . . . . 63.210000000000001 110.635 178.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.9 mt -74.32 -39.34 48.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.701 -0.682 . . . . 71.140000000000001 109.485 176.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.19 110.68 0.33 Allowed Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 114.928 -1.033 . . . . 70.209999999999994 112.077 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.0 p80 -91.71 150.79 20.95 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.826 0.346 . . . . 60.509999999999998 110.884 -177.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 33.4 tp -114.09 87.31 2.6 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.785 -0.82 . . . . 71.129999999999995 108.785 170.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.694 HG12 HG22 ' A' ' 70' ' ' VAL . 6.3 m -96.49 56.32 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.521 0.677 . . . . 62.009999999999998 110.892 -176.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 97.6 mt -116.35 133.67 55.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.4 -0.818 . . . . 71.319999999999993 110.295 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -144.3 -64.47 0.36 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.507 -0.553 . . . . 64.439999999999998 109.507 174.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -157.42 133.72 9.67 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 108.993 -0.743 . . . . 75.530000000000001 108.993 175.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -83.14 140.96 32.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.823 0.344 . . . . 71.140000000000001 110.368 -177.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -76.43 134.02 39.69 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.264 -0.425 . . . . 74.010000000000005 110.455 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 30.5 m -83.9 135.9 34.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.349 -0.387 . . . . 61.219999999999999 110.508 177.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 10.6 tt -82.97 94.0 3.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.689 0.757 . . . . 71.219999999999999 110.481 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 57.0 tp -136.22 121.13 18.68 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.395 -0.82 . . . . 64.340000000000003 109.947 -179.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 57.46 43.78 22.41 Favored 'General case' 0 C--O 1.235 0.295 0 O-C-N 123.758 0.661 . . . . 61.229999999999997 110.973 -178.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 116.26 -105.95 1.44 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.792 -0.64 . . . . 72.25 112.078 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.4 t -170.25 56.83 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.195 0.521 . . . . 34.130000000000003 109.825 -179.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.0 mp -108.37 104.29 13.63 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.238 -0.437 . . . . 64.209999999999994 110.692 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -139.0 98.07 0.24 Allowed Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.531 -0.628 . . . . 64.219999999999999 111.531 177.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 23.8 t -82.0 77.63 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.335 0.588 . . . . 75.019999999999996 110.833 -176.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.6 mp -128.4 117.92 20.16 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.338 -0.846 . . . . 70.319999999999993 109.335 174.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -71.95 113.91 3.81 Favored 'Trans proline' 0 C--O 1.234 0.321 0 C-N-CA 122.778 2.319 . . . . 74.400000000000006 111.854 178.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -69.0 139.81 55.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.321 -0.4 . . . . 74.230000000000004 110.222 179.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.408 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 63.2 mtt180 -114.1 155.22 26.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.198 -0.455 . . . . 74.299999999999997 110.275 -176.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.694 HG22 HG12 ' A' ' 51' ' ' VAL . 31.6 t -113.02 120.83 64.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.254 -0.43 . . . . 72.420000000000002 110.356 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.785 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.8 mp -114.89 143.52 45.0 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.609 0.242 . . . . 64.239999999999995 110.826 177.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.0 m -142.35 160.84 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 CA-C-N 116.179 -0.464 . . . . 74.230000000000004 110.112 175.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.519 ' HA ' ' HA ' ' A' ' 23' ' ' LEU . 2.0 p-80 -72.48 143.3 48.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.149 0.499 . . . . 74.310000000000002 111.255 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.898 ' HA ' HD23 ' A' ' 77' ' ' LEU . 31.1 tt0 -57.1 -37.01 71.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.056 -0.974 . . . . 63.229999999999997 113.059 -169.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -64.17 -18.95 64.96 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.33 0.492 . . . . 63.020000000000003 112.33 -171.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -117.12 15.22 15.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.019 0.438 . . . . 73.129999999999995 110.869 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.898 HD23 ' HA ' ' A' ' 74' ' ' GLU . 0.6 OUTLIER -58.96 -41.12 86.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.744 -0.662 . . . . 54.43 110.451 177.383 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.07 -40.33 80.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.913 -0.585 . . . . 75.219999999999999 111.187 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -72.91 -47.3 25.73 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.58 -0.819 . . . . 61.130000000000003 112.268 -178.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.462 ' O ' ' HG ' ' A' ' 84' ' ' LEU . . . -63.07 -41.82 99.53 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.717 0.266 . . . . 65.549999999999997 111.717 -177.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -58.84 -47.75 83.76 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-O 120.574 0.226 . . . . 75.510000000000005 110.887 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -56.52 -45.15 81.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.2 0.524 . . . . 75.120000000000005 110.372 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 45.1 tp -64.9 -52.04 58.64 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.474 -0.785 . . . . 74.430000000000007 111.256 -178.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.696 HD22 HG13 ' A' ' 38' ' ' VAL . 76.2 mt -70.41 -28.05 64.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.114 -0.494 . . . . 73.450000000000003 111.883 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.902 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.8 m -75.5 -49.49 18.59 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.645 0.26 . . . . 53.329999999999998 110.755 178.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -75.34 -44.15 46.81 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.042 0.386 . . . . 71.519999999999996 112.042 -174.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -115.04 20.15 15.24 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.152 0.427 . . . . 73.340000000000003 112.152 -173.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -125.84 -80.51 0.38 Allowed Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 120.176 -1.011 . . . . 73.219999999999999 111.527 176.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.618 HD12 ' N ' ' A' ' 90' ' ' ALA . 0.9 OUTLIER 176.77 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.763 0.425 . . . . 73.340000000000003 111.302 -176.827 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.902 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 65.12 7.05 3.83 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.165 0.802 . . . . 75.129999999999995 113.165 177.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -85.49 -33.95 21.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.923 0.392 . . . . 64.400000000000006 110.941 -177.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.564 ' HB3' ' O ' ' A' ' 28' ' ' ARG . 5.7 mm-40 -80.85 1.17 31.84 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.716 -0.674 . . . . 75.219999999999999 111.161 -174.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 83.7 mt -66.6 115.37 6.38 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.232 -0.44 . . . . 65.540000000000006 111.62 -174.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.422 ' H ' ' HA ' ' A' ' 27' ' ' LEU . 22.3 ttt180 72.05 -58.22 0.59 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 114.916 -1.038 . . . . 75.349999999999994 111.879 177.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 63.7 p -126.9 167.81 15.34 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.96 0.41 . . . . 65.219999999999999 110.87 -178.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -96.96 19.3 12.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.642 0.734 . . . . 74.530000000000001 109.608 176.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 30.8 t70 . . . . . 0 C--O 1.246 0.883 0 CA-C-N 115.25 -0.886 . . . . 75.129999999999995 110.658 -176.021 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 120.768 0.318 . . . . 70.120000000000005 110.46 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 162.12 113.89 0.31 Allowed Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.028 -0.606 . . . . 21.440000000000001 111.824 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.4 m -108.18 152.75 24.15 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.418 -0.586 . . . . 62.420000000000002 109.418 178.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.5 m -77.08 85.93 3.57 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.183 0.516 . . . . 64.120000000000005 110.103 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -89.43 73.42 7.89 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.668 0.747 . . . . 73.230000000000004 110.022 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -145.72 145.16 30.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.262 -0.881 . . . . 75.540000000000006 109.792 -179.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -131.04 114.92 15.78 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.975 -0.557 . . . . 63.450000000000003 109.837 178.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.8 p-80 -79.14 144.73 34.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.863 0.363 . . . . 72.219999999999999 110.527 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -159.53 122.58 3.6 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.459 -0.571 . . . . 63.109999999999999 109.459 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.0 t-80 -117.67 114.31 23.18 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.078 0.466 . . . . 75.109999999999999 110.361 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.9 m -152.52 85.8 1.26 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.616 -0.72 . . . . 62.530000000000001 109.676 177.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.9 t -162.81 150.85 13.92 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.768 -0.651 . . . . 33.009999999999998 109.56 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 149.66 149.99 5.14 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.821 -0.704 . . . . 64.030000000000001 112.11 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 70.1 mtp180 -134.92 -175.52 3.93 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.626 0.25 . . . . 75.439999999999998 110.334 179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -127.45 101.61 6.52 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.029 -0.532 . . . . 64.340000000000003 109.944 175.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -76.9 90.52 3.52 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.614 -0.884 . . . . 72.230000000000004 108.614 176.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -101.12 100.55 11.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.091 -0.504 . . . . 74.400000000000006 110.367 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -150.99 81.97 1.33 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.257 -0.883 . . . . 70.219999999999999 109.057 175.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -98.95 115.55 29.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.457 -0.792 . . . . 53.109999999999999 109.401 179.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -149.48 137.17 20.25 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.301 -0.629 . . . . 75.040000000000006 109.301 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -130.34 42.19 1.44 Allowed Glycine 0 C--N 1.329 0.162 0 C-N-CA 120.04 -1.076 . . . . 72.120000000000005 113.89 -170.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 20.9 m170 -106.7 172.69 6.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.908 0.385 . . . . 72.510000000000005 110.607 173.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.552 ' HG ' ' HD2' ' A' ' 73' ' ' HIS . 5.1 mp -117.2 142.77 46.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.041 -0.527 . . . . 75.230000000000004 110.285 -178.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.46 ' HB2' HD21 ' A' ' 77' ' ' LEU . 28.4 mmm-85 -133.35 133.84 43.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.039 -0.528 . . . . 74.310000000000002 110.149 -176.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.588 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 71.8 tt0 -68.59 114.74 7.24 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.529 -0.545 . . . . 63.329999999999998 109.529 173.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.508 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -84.72 -54.7 4.53 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.705 -0.48 . . . . 74.319999999999993 109.705 -175.89 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.571 HD11 HG21 ' A' ' 38' ' ' VAL . 2.1 pt? -148.27 160.7 42.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.149 0.5 . . . . 55.140000000000001 110.956 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.499 ' HG3' ' HG2' ' A' ' 69' ' ' ARG . 51.6 ttt180 -141.23 122.7 15.01 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.469 -0.787 . . . . 71.129999999999995 109.58 -178.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 t -150.26 177.81 9.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.675 0.274 . . . . 74.530000000000001 110.296 -177.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -124.67 -4.03 7.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.126 -0.488 . . . . 71.519999999999996 110.903 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -85.49 125.12 32.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.939 0.4 . . . . 75.219999999999999 110.769 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -68.6 -41.07 80.1 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.628 -0.715 . . . . 74.549999999999997 111.677 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.2 t -63.36 -43.26 98.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-O 121.277 0.561 . . . . 73.329999999999998 110.819 -176.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.53 ' CD2' ' HG3' ' A' ' 92' ' ' GLU . 47.6 tp -62.3 -44.46 96.47 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.791 -0.64 . . . . 53.439999999999998 110.798 178.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 68.2 mt -59.41 -39.56 83.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.274 -0.421 . . . . 75.150000000000006 111.266 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 50.7 m -62.47 -38.72 90.94 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.837 0.351 . . . . 64.120000000000005 110.958 178.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.455 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -66.83 -48.72 68.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 63.25 110.634 179.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.571 HG21 HD11 ' A' ' 27' ' ' LEU . 60.4 t -61.32 -39.92 84.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.971 -0.559 . . . . 51.409999999999997 110.6 178.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.64 -45.59 95.4 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.109 -0.567 . . . . 64.420000000000002 112.46 179.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.63 -28.98 69.99 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.904 0.383 . . . . 71.439999999999998 111.388 -178.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 93.3 mt -73.6 -51.47 16.74 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.141 -0.481 . . . . 63.049999999999997 110.333 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 81.0 mt -66.66 -39.36 88.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.784 -0.644 . . . . 70.530000000000001 111.11 -176.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -70.18 -36.87 74.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.779 0.323 . . . . 72.310000000000002 110.784 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.45 -32.26 78.7 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.689 -0.767 . . . . 73.450000000000003 112.526 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.06 11.78 26.43 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.504 0.192 . . . . 72.040000000000006 111.466 -178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.7 t70 59.26 30.15 19.84 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 122.016 0.912 . . . . 70.030000000000001 110.812 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 60.3 mt -83.97 -44.7 18.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.685 -0.688 . . . . 72.010000000000005 109.791 178.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.1 139.34 5.85 Favored Glycine 0 N--CA 1.446 -0.64 0 CA-C-N 115.036 -0.983 . . . . 71.349999999999994 111.253 -175.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 48.9 p-80 -123.75 117.14 24.26 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.101 0.477 . . . . 71.120000000000005 110.628 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.8 mt -101.71 96.51 7.14 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.781 -0.451 . . . . 74.319999999999993 109.781 176.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.7 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 30.6 m -101.41 -38.79 6.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.097 -0.501 . . . . 64.540000000000006 110.228 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.704 ' HG ' ' HB2' ' A' ' 54' ' ' GLN . 29.8 tp 64.56 119.42 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 O-C-N 124.35 1.031 . . . . 75.409999999999997 111.935 178.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.542 ' HA ' ' HE ' ' A' ' 68' ' ' ARG . 30.7 t70 -60.55 -58.24 9.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.703 . . . . 61.149999999999999 109.66 175.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.704 ' HB2' ' HG ' ' A' ' 52' ' ' LEU . 32.3 tt0 42.66 59.49 2.76 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.221 0.951 . . . . 75.209999999999994 111.94 175.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -85.57 76.16 10.05 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.33 0.586 . . . . 64.400000000000006 109.43 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 89.2 mtp -91.9 -54.12 3.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.389 -0.823 . . . . 74.340000000000003 109.984 -178.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 58.8 m -84.87 76.34 10.25 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.796 -0.638 . . . . 54.009999999999998 109.806 177.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 4.3 tp -77.36 92.39 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 CA-C-O 121.797 0.808 . . . . 71.010000000000005 109.833 178.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.443 ' O ' ' HA2' ' A' ' 64' ' ' GLY . 1.7 tm? -131.93 104.02 6.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.95 -1.023 . . . . 73.209999999999994 108.895 178.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -68.33 -77.5 0.08 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.562 -0.744 . . . . 75.0 110.927 -177.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.34 -76.95 0.47 Allowed Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.82 -0.705 . . . . 23.52 112.213 -176.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 36.5 m -124.23 -50.68 1.78 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.222 0.534 . . . . 72.140000000000001 110.303 176.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.2 mt -121.26 -36.88 3.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.997 -0.547 . . . . 61.399999999999999 111.426 -175.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.443 ' HA2' ' O ' ' A' ' 59' ' ' LEU . . . 83.78 71.91 1.3 Allowed Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 109.951 -1.259 . . . . 73.319999999999993 109.951 -169.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 44.4 t -83.24 95.06 3.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.126 0.489 . . . . 71.530000000000001 112.18 -169.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.6 mp -104.73 99.57 19.19 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.636 -0.876 . . . . 62.509999999999998 108.636 168.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -71.76 106.67 2.03 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.765 2.31 . . . . 75.329999999999998 111.941 -179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.542 ' HE ' ' HA ' ' A' ' 53' ' ' ASP . 81.5 mtt85 -87.72 133.43 33.85 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.563 -0.532 . . . . 70.099999999999994 109.563 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.7 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 60.1 mtp180 -120.03 137.94 53.8 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.779 -0.646 . . . . 45.25 109.722 -169.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.668 HG22 HG12 ' A' ' 51' ' ' VAL . 8.1 t -99.95 105.94 18.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.823 0.344 . . . . 72.310000000000002 110.728 -171.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.588 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 9.1 mp -104.2 127.7 51.84 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.126 -0.488 . . . . 54.009999999999998 110.58 177.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 29.7 m -109.56 -176.04 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.602 -0.726 . . . . 72.239999999999995 109.648 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.552 ' HD2' ' HG ' ' A' ' 23' ' ' LEU . 43.1 m80 -107.22 162.37 13.94 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.938 -0.305 . . . . 63.140000000000001 110.267 -179.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -59.48 -22.73 62.0 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.407 0.622 . . . . 75.200000000000003 109.978 173.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -50.25 -36.18 30.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.477 -1.238 . . . . 51.420000000000002 112.684 178.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -141.49 30.59 1.72 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.853 0.358 . . . . 72.109999999999999 110.605 -175.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.46 HD21 ' HB2' ' A' ' 24' ' ' ARG . 0.2 OUTLIER -57.95 -47.4 83.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.05 0.453 . . . . 65.5 110.593 -177.081 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.29 -40.49 74.23 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.003 -0.544 . . . . 74.049999999999997 111.129 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -66.39 -48.21 65.19 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.903 -0.665 . . . . 74.239999999999995 112.157 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.71 -41.2 77.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.764 0.316 . . . . 71.450000000000003 110.815 178.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -59.12 -53.98 52.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.353 -0.385 . . . . 72.239999999999995 111.078 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -64.73 -38.21 90.2 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 121.175 -0.21 . . . . 71.409999999999997 111.265 -178.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.3 tp -58.69 -47.98 82.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.077 0.465 . . . . 72.239999999999995 110.708 178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.582 ' HG ' HD11 ' A' ' 89' ' ' LEU . 11.1 mp -72.89 -28.67 62.62 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.056 -0.52 . . . . 73.400000000000006 111.213 179.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.688 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 89.5 m -66.36 -46.14 77.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 110.358 -0.238 . . . . 31.34 110.358 177.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.62 -31.74 72.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.274 -0.421 . . . . 73.409999999999997 110.72 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.96 -27.06 67.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.067 0.461 . . . . 24.219999999999999 111.115 177.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 99.73 -15.83 59.27 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.801 -0.714 . . . . 73.109999999999999 112.493 177.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.582 HD11 ' HG ' ' A' ' 84' ' ' LEU . 3.2 pp -84.55 9.42 13.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.766 0.317 . . . . 73.200000000000003 111.366 -177.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.688 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . -65.65 86.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.131 0.491 . . . . 65.230000000000004 110.039 174.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -163.77 -37.23 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.4 -0.818 . . . . 71.109999999999999 110.009 -177.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.53 ' HG3' ' CD2' ' A' ' 34' ' ' LEU . 20.8 mm-40 -80.44 4.13 19.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.319 -0.401 . . . . 62.119999999999997 110.91 178.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.454 ' CD1' ' HA ' ' A' ' 90' ' ' ALA . 10.2 mp -65.61 142.85 57.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.058 -0.519 . . . . 61.109999999999999 111.16 -177.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -118.52 71.6 0.85 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.935 -0.575 . . . . 73.439999999999998 110.008 177.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.1 p -81.8 31.29 0.36 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.58 -0.736 . . . . 71.430000000000007 111.299 -176.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -88.36 7.35 32.93 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.054 -0.521 . . . . 74.140000000000001 110.587 -176.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.459 -0.781 . . . . 44.32 109.754 177.536 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.117 0 CA-C-O 120.979 0.418 . . . . 74.409999999999997 110.34 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -119.74 42.47 1.75 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.444 -0.884 . . . . 60.530000000000001 112.107 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.0 m -140.19 91.17 2.43 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.068 0.461 . . . . 62.25 109.81 178.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 m -129.04 93.63 3.64 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.825 -0.625 . . . . 73.310000000000002 110.607 -176.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.8 m80 -133.56 88.36 2.47 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.128 -0.487 . . . . 71.129999999999995 111.09 176.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -113.59 118.47 34.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.759 -0.655 . . . . 71.439999999999998 109.477 173.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -158.77 113.16 2.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.258 -0.428 . . . . 75.319999999999993 110.201 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 16.6 p80 -141.52 127.05 18.9 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.778 -0.647 . . . . 71.150000000000006 109.847 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 28.6 t-80 -170.74 82.79 0.09 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.208 -0.451 . . . . 62.219999999999999 110.036 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -150.87 93.2 1.91 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.394 -0.366 . . . . 60.229999999999997 111.029 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 46.2 m -156.59 94.65 1.49 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.974 -0.557 . . . . 74.549999999999997 109.593 177.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 29.0 m -148.0 126.8 12.64 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.809 0.299 . . . . 54.219999999999999 111.809 -177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 92.69 130.4 5.31 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.119 -0.562 . . . . 55.32 114.189 170.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.72 157.27 37.8 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.231 -0.655 . . . . 74.150000000000006 109.231 170.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -129.41 119.53 23.97 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.072 0.463 . . . . 70.340000000000003 111.386 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -161.26 109.5 1.53 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.635 -0.712 . . . . 72.510000000000005 110.463 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.1 mt -85.41 105.67 16.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.992 0.425 . . . . 61.140000000000001 110.279 177.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -82.53 152.33 26.06 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.854 -0.612 . . . . 73.409999999999997 110.638 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -160.83 127.21 4.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.382 -0.372 . . . . 71.120000000000005 110.834 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.451 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 6.1 mm-40 -150.97 146.95 26.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.097 -0.501 . . . . 53.43 110.138 175.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 174.16 80.16 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.762 -0.733 . . . . 72.430000000000007 112.284 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.462 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 55.9 t-80 -164.28 149.1 10.01 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.85 -0.426 . . . . 74.530000000000001 109.85 -178.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 mp -124.96 144.26 50.46 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.83 -0.433 . . . . 72.340000000000003 109.83 175.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -115.71 148.74 39.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.622 0.249 . . . . 65.239999999999995 111.263 -176.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.933 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.8 tt0 -84.13 121.4 27.39 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.957 -0.565 . . . . 62.420000000000002 110.51 -178.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.436 ' CD1' HG22 ' A' ' 72' ' ' VAL . 9.8 mp -100.6 -66.21 0.92 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.803 0.668 . . . . 75.239999999999995 112.803 -173.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.619 ' CB ' ' HA ' ' A' ' 93' ' ' LEU . 2.4 pt? -142.25 169.22 18.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.18 0.514 . . . . 73.019999999999996 111.934 -171.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -100.87 136.19 41.11 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.089 -0.96 . . . . 73.010000000000005 109.443 176.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.8 p -117.74 92.32 3.81 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.539 0.685 . . . . 70.430000000000007 111.172 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.538 ' H ' HD22 ' A' ' 30' ' ' ASN . 0.1 OUTLIER -111.54 9.53 21.22 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.817 0.818 . . . . 74.0 109.352 175.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.482 ' HB3' ' HB3' ' A' ' 34' ' ' LEU . 18.1 t70 -114.03 125.53 54.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.83 -1.077 . . . . 53.329999999999998 109.799 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.24 -44.02 97.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.19 -0.459 . . . . 73.439999999999998 111.602 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 46.9 t -70.76 -44.58 76.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.309 -0.405 . . . . 54.409999999999997 110.668 -176.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.602 HD22 ' HG3' ' A' ' 92' ' ' GLU . 29.2 tp -58.65 -42.74 89.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.969 -0.56 . . . . 71.209999999999994 111.204 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 64.8 tp -62.49 -35.79 80.48 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.176 -0.465 . . . . 62.439999999999998 110.875 -177.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.2 m -70.55 -42.38 71.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 54.240000000000002 110.648 176.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.72 -54.1 31.84 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.064 -0.516 . . . . 55.210000000000001 111.537 -177.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.491 ' O ' ' HG ' ' A' ' 42' ' ' LEU . 87.1 t -62.7 -41.07 90.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.997 0.427 . . . . 64.340000000000003 110.662 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -64.36 -34.33 89.62 Favored Glycine 0 N--CA 1.453 -0.196 0 CA-C-N 115.784 -0.644 . . . . 64.420000000000002 112.489 -178.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.57 -36.28 68.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.932 0.396 . . . . 55.520000000000003 110.779 178.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 87.2 mt -65.74 -46.3 79.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.996 -0.547 . . . . 65.430000000000007 110.501 178.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 38' ' ' VAL . 85.7 mt -59.02 -47.77 84.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.577 -0.738 . . . . 64.349999999999994 110.559 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -68.56 -37.51 79.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.131 -0.486 . . . . 73.230000000000004 110.856 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.1 -20.76 67.36 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 115.788 -0.642 . . . . 50.130000000000003 113.182 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -109.68 7.97 24.6 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 122.802 -0.234 . . . . 75.430000000000007 111.218 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.7 t70 61.07 33.99 19.33 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.748 0.785 . . . . 72.239999999999995 110.665 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.928 HG23 ' HB3' ' A' ' 76' ' ' ASP . 84.8 mt -82.41 120.25 33.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.521 -0.763 . . . . 62.030000000000001 110.321 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.68 109.45 2.91 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.927 -0.654 . . . . 71.420000000000002 111.747 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 35.4 p-80 -126.39 148.14 49.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.976 0.417 . . . . 72.310000000000002 111.065 -174.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 65.5 tp -127.99 127.98 44.2 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.774 -0.648 . . . . 65.219999999999999 109.579 176.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.3 m -102.77 126.32 57.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.989 0.423 . . . . 74.219999999999999 110.948 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.836 HD23 HD13 ' A' ' 71' ' ' LEU . 4.0 mm? -102.82 114.46 28.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.915 -0.584 . . . . 52.350000000000001 109.61 176.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -86.62 -64.31 1.17 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.418 -0.355 . . . . 54.25 110.764 -176.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 68.07 120.86 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 O-C-N 124.125 0.89 . . . . 61.350000000000001 112.384 178.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -114.55 167.03 11.09 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.761 -0.654 . . . . 61.240000000000002 109.838 173.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.22 153.96 42.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.8 0.333 . . . . 72.010000000000005 111.486 -175.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.0 m -59.98 157.21 13.12 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.879 -0.6 . . . . 71.400000000000006 111.034 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.57 ' O ' ' HB2' ' A' ' 59' ' ' LEU . 5.4 tp -72.58 96.23 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-O 121.272 0.558 . . . . 65.129999999999995 111.535 -177.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.57 ' HB2' ' O ' ' A' ' 58' ' ' ILE . 0.5 OUTLIER 167.31 97.73 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 108.128 -1.064 . . . . 62.020000000000003 108.128 177.068 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 64.88 92.33 0.07 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.552 0.691 . . . . 62.329999999999998 110.533 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -114.1 46.48 1.16 Allowed Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.743 -0.741 . . . . 43.520000000000003 113.196 -176.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 5.8 p -83.47 -54.75 4.74 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.011 0.434 . . . . 42.039999999999999 110.33 174.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.2 mp -110.77 134.53 52.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.179 -0.464 . . . . 75.349999999999994 110.503 178.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -134.62 -67.05 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.436 -0.666 . . . . 73.439999999999998 111.436 176.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.5 t 59.95 64.66 0.16 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-O 121.64 0.733 . . . . 73.019999999999996 110.363 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.8 mp -103.86 111.17 65.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 115.516 -0.765 . . . . 52.119999999999997 109.282 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.89 114.82 3.3 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.498 2.132 . . . . 44.020000000000003 111.813 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 -58.96 136.89 58.05 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.505 -0.554 . . . . 72.219999999999999 109.505 175.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.403 ' HD3' ' OE2' ' A' ' 25' ' ' GLU . 74.3 mtt180 -113.35 139.45 48.86 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.853 0.358 . . . . 74.420000000000002 110.905 -175.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 58.4 t -105.38 118.49 52.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.02 -0.536 . . . . 62.119999999999997 110.68 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.933 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.9 mp -114.96 150.23 36.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.843 -0.617 . . . . 65.049999999999997 109.771 177.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.809 HG23 HD22 ' A' ' 77' ' ' LEU . 34.4 m -130.56 163.3 36.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.295 0.569 . . . . 72.019999999999996 111.233 177.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.44 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 41.2 t-80 -75.87 150.89 37.53 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.274 -0.875 . . . . 63.229999999999997 110.841 -176.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 24.4 mm-40 -38.74 -64.72 0.42 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.148 1.166 . . . . 73.030000000000001 114.148 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -67.38 -19.09 65.36 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.442 0.639 . . . . 65.030000000000001 110.963 -174.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.928 ' HB3' HG23 ' A' ' 47' ' ' ILE . 2.4 m-20 -85.73 -14.06 46.47 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.343 -0.844 . . . . 71.420000000000002 110.613 -176.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.809 HD22 HG23 ' A' ' 72' ' ' VAL . 1.6 mm? -52.72 -57.94 8.47 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.095 -0.502 . . . . 74.099999999999994 111.409 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.56 -42.88 83.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.996 -0.547 . . . . 55.140000000000001 111.056 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.42 -48.11 77.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.813 -0.708 . . . . 21.43 112.555 -178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.498 ' HB2' HG21 ' A' ' 47' ' ' ILE . . . -65.47 -47.31 76.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.648 0.261 . . . . 75.230000000000004 111.417 -178.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.539 ' HD2' HD12 ' A' ' 77' ' ' LEU . 39.3 mtp180 -64.44 -38.83 92.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.402 -0.363 . . . . 72.310000000000002 110.582 -177.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 82' ' ' ARG . 40.9 ttt-85 -66.42 -44.33 83.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.116 0.484 . . . . 64.200000000000003 110.389 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 44.4 tp -62.31 -47.52 83.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.586 -0.733 . . . . 73.519999999999996 111.283 -177.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.87 -28.72 70.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.299 -0.41 . . . . 63.299999999999997 110.962 178.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.9 m -74.46 -39.15 62.7 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.827 0.346 . . . . 55.439999999999998 110.505 177.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -66.49 -37.02 84.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.024 0.44 . . . . 73.340000000000003 110.688 179.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.26 -17.27 52.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.971 -0.559 . . . . 74.310000000000002 111.172 178.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 78.16 28.54 55.92 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.863 -0.608 . . . . 73.200000000000003 112.796 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.8 mt -103.56 5.09 36.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.977 0.418 . . . . 74.019999999999996 110.639 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.819 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -76.22 73.03 3.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.297 0.57 . . . . 64.310000000000002 110.681 178.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -129.31 -34.24 1.86 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.759 -0.655 . . . . 63.140000000000001 110.407 179.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.602 ' HG3' HD22 ' A' ' 34' ' ' LEU . 51.7 mm-40 -98.18 8.7 44.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.582 -0.735 . . . . 75.019999999999996 111.011 -175.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.819 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.8 mp -80.99 121.34 25.92 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.822 -0.436 . . . . 65.400000000000006 109.822 -179.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.4 ttt180 -79.43 80.19 5.82 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.51 0.671 . . . . 65.019999999999996 110.327 -177.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 39.6 t -111.98 83.66 1.83 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.263 -0.88 . . . . 71.349999999999994 108.994 175.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -64.89 -34.73 79.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.581 0.705 . . . . 75.329999999999998 109.116 177.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 p30 . . . . . 0 C--O 1.254 1.293 0 CA-C-N 114.858 -1.065 . . . . 71.409999999999997 109.254 176.378 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.4 ttp . . . . . 0 N--CA 1.482 1.143 0 CA-C-O 120.802 0.335 . . . . 74.140000000000001 110.247 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.12 60.14 0.92 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.518 -0.849 . . . . 61.119999999999997 112.505 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 10.7 m -77.78 99.77 6.02 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.465 -0.568 . . . . 64.129999999999995 109.465 176.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.9 t -129.9 101.34 5.81 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.459 -0.337 . . . . 51.229999999999997 110.942 -174.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -82.76 132.3 35.18 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.624 -0.51 . . . . 64.420000000000002 109.624 176.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -98.9 122.82 42.65 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.253 0.549 . . . . 72.420000000000002 111.565 -173.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.0 p-80 -133.23 115.44 14.98 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.374 -0.83 . . . . 75.510000000000005 109.171 175.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 18.8 t-80 -138.28 -15.9 1.25 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.284 -0.416 . . . . 72.430000000000007 110.737 -176.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -76.61 77.07 3.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.184 0.516 . . . . 72.239999999999995 110.314 177.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -93.5 -33.6 13.72 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.62 -0.718 . . . . 74.439999999999998 109.646 178.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 p -82.65 114.1 20.79 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.516 -0.766 . . . . 64.019999999999996 110.066 177.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 27.0 t -140.22 107.65 5.56 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.991 -0.549 . . . . 70.099999999999994 110.482 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 107.2 146.99 13.41 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 111.325 -0.71 . . . . 53.140000000000001 111.325 -176.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.5 ptp85 -143.18 -14.65 0.69 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.141 0.47 . . . . 65.140000000000001 111.931 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -78.56 81.35 4.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.801 0.81 . . . . 75.400000000000006 110.803 -177.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -126.81 37.88 4.21 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 107.573 -1.269 . . . . 74.400000000000006 107.573 175.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.99 98.41 5.69 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.582 -1.19 . . . . 74.209999999999994 110.725 -174.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -123.88 -74.28 0.62 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.536 -0.913 . . . . 74.400000000000006 108.536 171.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 44.0 t80 70.26 -8.64 0.84 Allowed 'General case' 0 N--CA 1.471 0.586 0 O-C-N 123.96 0.787 . . . . 74.5 112.361 170.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -58.08 124.12 18.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.207 -0.451 . . . . 73.409999999999997 110.989 -177.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.601 ' HA3' ' HB2' ' A' ' 74' ' ' GLU . . . 146.8 111.71 0.69 Allowed Glycine 0 N--CA 1.441 -1.027 0 C-N-CA 119.719 -1.229 . . . . 62.439999999999998 113.528 176.138 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.531 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -85.52 6.63 26.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.819 0.343 . . . . 61.409999999999997 110.434 172.407 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 22' ' ' HIS . 11.0 mp 84.31 139.17 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.22 1.008 . . . . 64.200000000000003 112.479 173.611 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -117.17 155.24 29.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.018 -0.992 . . . . 71.150000000000006 109.442 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.875 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 37.5 tt0 -85.09 121.87 28.49 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.844 -0.799 . . . . 75.219999999999999 108.844 171.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 93' ' ' LEU . 10.9 mp -87.42 -66.53 0.9 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.359 -0.382 . . . . 74.329999999999998 111.433 -176.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.542 HD21 HG11 ' A' ' 38' ' ' VAL . 4.0 pp -143.02 160.83 39.63 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.718 -0.393 . . . . 61.520000000000003 111.041 -175.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -144.07 129.18 18.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.513 -0.767 . . . . 74.299999999999997 109.385 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.401 HG21 HD23 ' A' ' 34' ' ' LEU . 11.2 t -151.49 163.46 38.96 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.964 0.411 . . . . 72.439999999999998 110.814 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -110.69 0.59 17.51 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.803 -0.635 . . . . 64.040000000000006 110.758 -177.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -94.43 123.55 37.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.892 0.377 . . . . 75.109999999999999 110.768 -179.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.26 -27.77 63.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.849 -0.614 . . . . 61.200000000000003 111.75 -175.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.28 -50.53 72.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.954 0.407 . . . . 71.319999999999993 110.284 179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.401 HD23 HG21 ' A' ' 29' ' ' THR . 55.7 tp -62.4 -40.19 95.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.067 -0.515 . . . . 70.109999999999999 110.47 176.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.509 HD22 ' HD2' ' A' ' 68' ' ' ARG . 76.7 mt -62.15 -31.28 71.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.859 -0.61 . . . . 73.409999999999997 111.351 177.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.0 m -75.6 -44.84 40.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.792 0.33 . . . . 75.219999999999999 110.501 177.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.482 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -59.94 -50.5 73.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 64.340000000000003 111.055 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.542 HG11 HD21 ' A' ' 27' ' ' LEU . 95.8 t -69.84 -41.93 79.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-O 121.104 0.478 . . . . 65.019999999999996 110.448 178.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.62 -49.13 81.83 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.742 -0.663 . . . . 53.340000000000003 112.793 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.43 -26.41 67.85 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.704 0.261 . . . . 65.549999999999997 111.704 -177.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.561 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.6 mt -69.9 -52.25 26.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.018 0.437 . . . . 73.019999999999996 110.616 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.3 mt -74.5 -39.58 62.35 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.015 -0.538 . . . . 74.540000000000006 111.067 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -68.61 -42.4 78.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.998 -0.546 . . . . 74.129999999999995 110.794 -177.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.96 -29.31 67.18 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 121.12 -0.562 . . . . 51.530000000000001 112.737 -177.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -85.74 -0.75 56.08 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.68 -0.306 . . . . 74.510000000000005 111.184 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.7 t70 66.82 21.23 10.51 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.611 0.72 . . . . 74.349999999999994 110.941 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 63.6 mt -75.84 142.83 13.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.699 -0.682 . . . . 70.129999999999995 109.528 177.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.52 113.44 4.91 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.963 -0.637 . . . . 61.329999999999998 111.832 177.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 33.6 p-80 -128.3 99.3 5.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.328 0.585 . . . . 60.409999999999997 111.532 -173.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.6 tp -83.21 89.0 6.91 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.839 -0.619 . . . . 70.540000000000006 109.373 176.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.658 HG12 HG22 ' A' ' 70' ' ' VAL . 14.9 m -107.29 114.18 45.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.592 -0.731 . . . . 65.239999999999995 110.502 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 pp -130.82 135.25 47.56 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.054 -0.521 . . . . 73.230000000000004 110.79 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.504 ' HA ' ' HA ' ' A' ' 68' ' ' ARG . 2.5 p30 -107.59 175.43 5.49 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.539 -0.541 . . . . 64.409999999999997 109.539 175.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -113.39 86.35 2.37 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.16 0.505 . . . . 73.230000000000004 112.005 -172.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -110.44 96.51 6.24 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.488 -0.93 . . . . 54.25 108.488 169.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 27.9 ttt -122.62 77.23 1.41 Allowed 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.88 -0.328 . . . . 73.010000000000005 111.304 -172.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.3 t 62.48 103.99 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.325 0 O-C-N 123.898 0.749 . . . . 64.519999999999996 112.035 174.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.3 tt -69.04 128.41 32.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.178 0.513 . . . . 30.25 110.36 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.606 HD23 ' HG2' ' A' ' 60' ' ' GLU . 5.8 tt -121.79 107.37 12.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.939 -0.763 . . . . 75.400000000000006 108.939 -179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.606 ' HG2' HD23 ' A' ' 59' ' ' LEU . 12.7 pt-20 43.73 -156.24 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 O-C-N 124.308 1.005 . . . . 61.210000000000001 112.262 -175.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -72.12 71.91 0.95 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.121 -0.561 . . . . 41.530000000000001 112.367 178.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.6 t -143.35 125.44 15.38 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.51 -0.552 . . . . 70.120000000000005 109.51 179.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.408 HD12 ' N ' ' A' ' 63' ' ' LEU . 5.9 mp -100.28 -34.57 9.94 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.285 0.564 . . . . 72.349999999999994 110.068 -178.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 69.64 -135.67 27.05 Favored Glycine 0 N--CA 1.443 -0.878 0 CA-C-N 115.518 -0.765 . . . . 63.030000000000001 111.398 -175.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.583 ' O ' ' HD3' ' A' ' 67' ' ' PRO . 58.7 t -134.47 126.36 48.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.103 -0.703 . . . . 71.209999999999994 109.103 176.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 66' ' ' ILE . 4.4 mp -110.68 85.69 5.06 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 110.019 -0.363 . . . . 73.140000000000001 110.019 178.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.583 ' HD3' ' O ' ' A' ' 65' ' ' VAL . 49.0 Cg_endo -97.57 105.99 0.08 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 123.256 2.637 . . . . 60.340000000000003 112.143 177.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.509 ' HD2' HD22 ' A' ' 35' ' ' LEU . 42.2 ttm180 -74.01 132.66 42.6 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.391 -0.596 . . . . 74.140000000000001 109.391 177.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -113.02 134.49 54.49 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.883 -0.599 . . . . 75.019999999999996 109.514 -174.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.658 HG22 HG12 ' A' ' 51' ' ' VAL . 42.5 t -112.85 118.63 58.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.097 -0.501 . . . . 71.420000000000002 110.8 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.875 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.1 mp -122.71 143.03 50.07 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.136 -0.484 . . . . 74.25 110.058 177.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.51 HG23 HD22 ' A' ' 77' ' ' LEU . 33.0 m -133.56 169.91 20.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.728 -0.215 . . . . 51.420000000000002 110.59 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -74.01 142.19 45.78 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.184 -0.673 . . . . 74.200000000000003 109.184 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.734 ' HA ' HD23 ' A' ' 77' ' ' LEU . 40.3 mt-10 -73.57 -8.46 56.06 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.198 0.814 . . . . 61.240000000000002 113.198 -171.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -86.31 -23.69 26.17 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.204 0.526 . . . . 73.420000000000002 109.77 174.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -101.18 8.65 42.55 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.745 -0.661 . . . . 61.039999999999999 110.132 172.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.734 HD23 ' HA ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -59.05 -55.39 35.73 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.823 -0.626 . . . . 72.439999999999998 110.115 -178.291 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.38 -36.32 71.11 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.129 -0.487 . . . . 64.409999999999997 111.12 177.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.37 -49.14 72.67 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.982 -0.628 . . . . 74.530000000000001 112.007 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.05 -42.94 93.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.502 0.192 . . . . 75.040000000000006 111.108 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.657 ' HD2' HD12 ' A' ' 77' ' ' LEU . 74.8 mtp180 -58.64 -47.25 85.05 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.507 -0.315 . . . . 74.140000000000001 110.412 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.2 tpt180 -58.72 -47.26 85.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.195 -0.457 . . . . 75.340000000000003 110.304 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.561 HD21 ' HB3' ' A' ' 41' ' ' LEU . 46.8 tp -60.94 -49.61 76.76 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.729 -0.669 . . . . 75.209999999999994 111.101 -178.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.526 HD21 HG13 ' A' ' 38' ' ' VAL . 84.5 mt -64.93 -36.77 85.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.471 -0.331 . . . . 75.109999999999999 111.351 -178.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 33.2 m -70.99 -41.76 70.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.899 0.38 . . . . 72.310000000000002 110.404 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -65.98 -34.51 78.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.939 -0.573 . . . . 64.540000000000006 110.694 -179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.54 -34.29 60.73 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.932 -0.576 . . . . 70.319999999999993 111.195 177.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 98.96 28.64 7.66 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.807 -0.711 . . . . 75.049999999999997 111.916 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 97.4 mt -113.79 -1.9 13.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.154 0.502 . . . . 72.420000000000002 110.897 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.569 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -75.0 93.61 2.74 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.547 . . . . 54.340000000000003 110.024 177.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -155.13 -44.71 0.08 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.96 -0.564 . . . . 75.120000000000005 110.346 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 48.5 mm-40 -84.27 10.6 10.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.097 -0.501 . . . . 65.5 111.209 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.569 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.3 mp -77.79 101.08 6.55 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.191 -0.459 . . . . 64.200000000000003 109.764 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.445 ' HA ' ' HD2' ' A' ' 94' ' ' ARG . 15.2 tpt180 -98.61 107.23 19.63 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.245 -0.434 . . . . 74.209999999999994 110.494 -175.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.7 p -121.37 170.2 9.86 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.869 -0.605 . . . . 75.349999999999994 110.615 -178.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.7 t0 -89.74 103.05 15.73 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.292 -0.413 . . . . 73.140000000000001 110.112 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.33 -0.843 . . . . 73.400000000000006 109.692 177.377 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.9 tpt . . . . . 0 N--CA 1.482 1.172 0 CA-C-O 120.637 0.256 . . . . 74.239999999999995 110.711 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.2 -6.56 0.15 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.018 -1.087 . . . . 74.450000000000003 113.177 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.1 p -76.39 100.42 5.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.194 0.521 . . . . 63.219999999999999 110.867 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.6 m -152.01 -171.17 3.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.921 -0.581 . . . . 74.540000000000006 109.682 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.6 t60 75.06 -36.0 0.3 Allowed 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.077 0.551 . . . . 72.340000000000003 111.756 177.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -77.12 86.62 3.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.447 0.641 . . . . 75.540000000000006 109.887 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.1 t60 -135.96 121.95 20.07 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.495 -0.775 . . . . 73.230000000000004 109.202 -177.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -152.29 155.09 37.0 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.752 -0.203 . . . . 73.129999999999995 110.869 -177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -159.92 106.5 1.62 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.966 0.413 . . . . 73.409999999999997 110.292 176.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.7 t-80 -139.34 80.85 1.8 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.884 -0.598 . . . . 73.319999999999993 109.988 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.7 p -98.68 91.36 5.08 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.006 -0.543 . . . . 62.229999999999997 110.687 -178.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.1 p -132.58 110.89 10.78 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.046 -0.525 . . . . 63.240000000000002 111.095 -177.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 135.15 131.65 3.08 Favored Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 120.476 -0.869 . . . . 61.009999999999998 112.354 178.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -118.49 -37.38 3.32 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.8 0.333 . . . . 74.129999999999995 110.525 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -99.4 109.71 22.27 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 121.4 0.619 . . . . 64.230000000000004 110.682 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -160.46 31.6 0.16 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.902 -1.147 . . . . 72.140000000000001 107.902 175.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 76.9 mt -78.73 102.23 7.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.473 -1.239 . . . . 63.039999999999999 111.779 -171.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -122.05 139.36 53.8 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.659 -0.867 . . . . 73.129999999999995 108.659 172.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -67.76 -46.31 72.44 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 123.411 0.444 . . . . 72.109999999999999 111.64 -168.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.19 100.61 10.14 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.662 -0.496 . . . . 73.409999999999997 109.662 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -97.09 1.77 61.09 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.471 -0.871 . . . . 62.100000000000001 113.535 -173.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.424 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 53.5 t60 -97.62 10.62 39.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 117.088 0.444 . . . . 65.510000000000005 110.57 -177.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.612 HD22 ' HB2' ' A' ' 50' ' ' LEU . 8.6 mp 71.23 148.69 0.08 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.99 -0.55 . . . . 72.109999999999999 111.515 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 50.7 mtm180 -110.35 145.39 37.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.288 -0.415 . . . . 70.420000000000002 111.348 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.528 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 32.1 tt0 -70.88 110.96 5.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.651 -0.704 . . . . 70.040000000000006 109.877 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.477 HD22 HG21 ' A' ' 72' ' ' VAL . 57.0 tp -98.85 -38.23 9.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.211 -0.45 . . . . 50.240000000000002 111.348 -174.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.592 ' HG ' ' HB ' ' A' ' 70' ' ' VAL . 1.0 OUTLIER -142.55 148.8 38.16 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.259 0.552 . . . . 74.400000000000006 110.805 179.362 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 28' ' ' ARG . 22.5 ttt180 -138.63 104.61 5.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.334 -0.848 . . . . 71.319999999999993 109.113 -174.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.7 t -121.14 175.84 5.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.43 0.633 . . . . 63.32 112.052 -170.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -130.34 17.54 5.43 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.019 -0.991 . . . . 72.230000000000004 110.58 -175.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -128.34 126.58 41.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 72.310000000000002 111.25 -177.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.674 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -76.95 -26.39 53.95 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.067 -0.515 . . . . 71.299999999999997 111.678 -177.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.9 t -68.71 -45.9 80.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.077 0.465 . . . . 70.340000000000003 109.842 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.15 -38.86 90.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.857 -0.611 . . . . 73.219999999999999 110.303 175.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.674 HD12 ' HA ' ' A' ' 32' ' ' ALA . 69.1 mt -58.37 -37.7 75.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 74.209999999999994 111.281 176.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.3 m -64.99 -37.05 86.39 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 51.530000000000001 110.276 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.74 -54.15 8.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.999 -0.546 . . . . 65.409999999999997 111.08 179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.574 HG11 HD11 ' A' ' 27' ' ' LEU . 99.5 t -60.58 -38.78 79.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.247 -0.433 . . . . 73.5 111.075 -178.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.66 -51.48 58.44 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.864 -0.607 . . . . 74.340000000000003 112.196 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.91 -31.23 72.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.644 0.259 . . . . 32.439999999999998 111.355 -179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 84.1 mt -65.69 -52.14 53.83 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.937 0.399 . . . . 62.020000000000003 110.725 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.4 mt -70.53 -39.1 74.25 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.919 -0.582 . . . . 74.299999999999997 110.563 -177.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.73 -36.74 81.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 71.010000000000005 110.403 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.85 -24.25 62.51 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 121.047 -0.596 . . . . 64.109999999999999 113.067 -179.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.61 6.82 42.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.927 0.364 . . . . 74.120000000000005 111.464 -177.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.1 t70 67.42 21.2 9.75 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.479 0.657 . . . . 64.420000000000002 110.372 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.818 HG23 ' HB3' ' A' ' 76' ' ' ASP . 78.5 mt -83.14 128.48 38.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.053 -0.521 . . . . 75.129999999999995 110.268 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.32 113.48 5.87 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.104 -0.57 . . . . 71.400000000000006 112.056 179.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.56 137.54 52.52 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.117 0.484 . . . . 74.430000000000007 111.431 -177.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.853 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 5.9 tt -107.79 95.17 5.5 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.901 -0.778 . . . . 54.539999999999999 108.901 174.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.454 HG11 HG22 ' A' ' 70' ' ' VAL . 0.3 OUTLIER -142.98 110.9 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.582 -0.736 . . . . 64.25 110.176 178.144 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -113.67 135.51 53.85 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.108 -0.496 . . . . 74.329999999999998 110.886 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -81.23 68.62 7.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.751 0.786 . . . . 45.299999999999997 109.791 175.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -136.7 117.14 13.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.96 -1.018 . . . . 72.129999999999995 109.433 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -152.96 -50.83 0.1 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.903 -0.59 . . . . 72.400000000000006 110.091 -177.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -151.78 171.54 17.54 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.1 -0.704 . . . . 42.409999999999997 109.1 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.6 m -70.53 146.8 49.94 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 110.174 -0.306 . . . . 71.420000000000002 110.174 177.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 8.1 tt -73.35 116.36 15.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.393 0.615 . . . . 75.25 111.135 -178.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 58.0 tp -158.34 111.17 2.35 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.44 -0.8 . . . . 70.25 109.901 179.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 67.89 170.46 0.27 Allowed 'General case' 0 C--O 1.234 0.24 0 O-C-N 123.815 0.697 . . . . 72.319999999999993 111.111 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -80.05 91.22 1.31 Allowed Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 110.901 -0.879 . . . . 64.420000000000002 110.901 172.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.679 ' HB3' HG12 ' A' ' 65' ' ' VAL . 15.6 m -54.73 127.72 29.54 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 122.715 0.406 . . . . 54.119999999999997 111.281 -175.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 63' ' ' LEU . 6.3 mp -80.15 80.63 6.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.904 -0.589 . . . . 71.340000000000003 111.496 -174.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 53.58 41.25 64.33 Favored Glycine 0 C--N 1.332 0.313 0 CA-C-N 115.861 -0.609 . . . . 52.009999999999998 113.717 175.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.679 HG12 ' HB3' ' A' ' 62' ' ' SER . 9.7 p -105.96 15.24 7.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 121.467 0.651 . . . . 41.43 110.615 -177.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.3 mp -120.22 88.07 40.95 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.279 -0.419 . . . . 74.019999999999996 110.634 178.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -81.65 141.41 12.29 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.357 2.038 . . . . 65.400000000000006 110.251 171.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.471 ' HA ' ' NE ' ' A' ' 68' ' ' ARG . 5.3 mmp_? -127.57 150.83 49.54 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.46 0.648 . . . . 75.530000000000001 111.417 -175.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.492 ' HD3' ' OE1' ' A' ' 25' ' ' GLU . 18.9 ptp180 -114.72 136.85 52.61 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.832 -1.076 . . . . 74.329999999999998 108.948 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.592 ' HB ' ' HG ' ' A' ' 27' ' ' LEU . 97.8 t -108.52 114.4 46.58 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 120.953 0.406 . . . . 71.109999999999999 110.272 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.853 ' HB2' ' HB3' ' A' ' 50' ' ' LEU . 8.5 mp -101.53 140.12 36.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.573 -0.74 . . . . 71.430000000000007 109.4 176.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.864 HG23 HD22 ' A' ' 77' ' ' LEU . 23.9 m -126.16 162.94 28.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.325 0.583 . . . . 71.319999999999993 111.13 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.463 ' HB3' ' OD1' ' A' ' 76' ' ' ASP . 2.5 t-160 -74.22 162.19 29.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.079 -0.964 . . . . 70.340000000000003 110.257 -175.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.588 ' O ' ' HB2' ' A' ' 77' ' ' LEU . 26.0 mm-40 -58.09 -58.88 6.49 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.85 0.685 . . . . 71.329999999999998 112.85 -174.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -73.33 -25.31 60.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.557 0.694 . . . . 64.239999999999995 110.041 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.818 ' HB3' HG23 ' A' ' 47' ' ' ILE . 1.5 m-20 -74.24 -14.65 60.95 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.168 -0.923 . . . . 63.539999999999999 110.63 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.864 HD22 HG23 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -53.49 -57.79 9.44 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.01 0.524 . . . . 71.040000000000006 111.249 -177.338 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.8 -38.34 90.74 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.691 -0.686 . . . . 70.129999999999995 111.04 -178.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.52 -44.99 94.37 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.902 -0.666 . . . . 74.420000000000002 112.124 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.58 97.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.728 0.299 . . . . 74.319999999999993 110.714 179.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 -60.88 -50.94 71.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.43 . . . . 63.32 110.59 178.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -57.67 -43.95 85.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 64.510000000000005 110.819 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.6 tp -59.84 -54.74 42.67 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.028 -0.533 . . . . 72.030000000000001 111.054 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.479 HD21 HG13 ' A' ' 38' ' ' VAL . 90.4 mt -63.18 -30.78 71.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.996 -0.547 . . . . 75.310000000000002 111.385 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 88.4 m -66.79 -43.0 85.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.573 0.225 . . . . 72.349999999999994 110.812 178.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -69.09 -34.11 74.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.978 0.418 . . . . 60.509999999999998 110.582 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -80.95 -4.26 54.42 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.904 -0.589 . . . . 73.109999999999999 111.673 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 72.32 21.67 79.24 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.99 -0.624 . . . . 72.030000000000001 112.785 179.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.0 mt -105.47 10.26 33.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.08 0.467 . . . . 73.209999999999994 110.829 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.724 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -73.78 77.09 1.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.45 -0.574 . . . . 61.530000000000001 109.45 174.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -131.56 -51.22 0.99 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.332 -0.849 . . . . 71.329999999999998 110.421 -172.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -91.74 8.83 35.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.598 -0.728 . . . . 75.420000000000002 110.974 -176.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.724 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.3 mp -73.47 134.37 43.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.168 -0.469 . . . . 73.5 110.319 -178.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 53.3 mtt180 -149.8 165.35 32.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.064 -0.516 . . . . 72.109999999999999 110.8 -177.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 68.9 m -152.96 139.7 18.93 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.609 -0.723 . . . . 71.420000000000002 109.123 173.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -80.66 83.33 6.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.522 -0.547 . . . . 74.129999999999995 109.522 178.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 27.2 t70 . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.466 -0.778 . . . . 73.319999999999993 110.507 -174.838 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 110.045 -0.354 . . . . 61.149999999999999 110.045 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 102.24 126.66 5.9 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 120.599 -0.81 . . . . 61.43 112.951 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.4 t -130.94 125.47 33.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.648 -0.871 . . . . 70.219999999999999 108.648 173.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.3 m -139.78 117.96 11.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.112 0.482 . . . . 30.23 111.658 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -162.7 96.01 0.92 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.614 -0.721 . . . . 75.430000000000007 109.748 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -140.3 92.16 2.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.831 0.824 . . . . 52.030000000000001 111.194 178.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.1 m170 -131.68 85.75 2.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.743 -0.662 . . . . 74.430000000000007 109.825 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.3 t-80 -160.2 84.04 0.72 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.787 -0.642 . . . . 71.540000000000006 110.457 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -157.46 42.65 0.32 Allowed 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.45 -0.574 . . . . 74.010000000000005 109.45 178.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 35.9 t-80 -83.98 86.92 7.12 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.975 -0.75 . . . . 74.010000000000005 108.975 176.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 32.6 m -155.07 102.66 2.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.695 -0.684 . . . . 63.109999999999999 109.92 -175.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -149.65 114.42 5.33 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.374 -0.376 . . . . 60.450000000000003 110.399 179.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -107.86 169.66 14.69 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.733 -0.746 . . . . 62.219999999999999 111.795 178.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.9 ptt180 -115.71 102.78 10.05 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.063 0.459 . . . . 71.439999999999998 110.792 -179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -82.97 132.66 35.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.035 0.445 . . . . 73.019999999999996 110.071 177.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -93.91 123.36 37.22 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.938 -0.574 . . . . 61.409999999999997 110.914 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.8 mt -135.11 106.26 6.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.166 -0.47 . . . . 70.140000000000001 110.777 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -92.98 -66.42 0.93 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.027 0.441 . . . . 71.209999999999994 109.973 174.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.0 t80 62.56 -170.53 0.17 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 115.062 -0.972 . . . . 74.230000000000004 109.836 -176.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -142.52 136.37 29.27 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.172 -0.677 . . . . 74.230000000000004 109.172 178.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.402 ' HA3' ' HG2' ' A' ' 24' ' ' ARG . . . -135.11 -68.24 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 119.702 -1.237 . . . . 63.520000000000003 113.28 -176.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 32.9 m80 57.27 83.45 0.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.35 -0.611 . . . . 74.519999999999996 109.35 -169.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.3 mt 66.55 101.17 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.343 -0.844 . . . . 74.049999999999997 110.027 -168.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.498 ' HB2' HD23 ' A' ' 77' ' ' LEU . 87.7 mtt180 -107.11 147.78 29.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.082 -0.508 . . . . 73.409999999999997 110.189 -174.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.621 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 35.7 tt0 -72.83 136.67 45.41 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.529 -0.545 . . . . 63.420000000000002 109.529 177.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.639 HD12 HD22 ' A' ' 27' ' ' LEU . 1.4 tm? -97.75 -50.45 4.45 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.716 -0.476 . . . . 61.549999999999997 109.716 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.639 HD22 HD12 ' A' ' 26' ' ' LEU . 2.6 pt? -158.39 157.98 33.35 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.472 -0.331 . . . . 75.099999999999994 110.805 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.19 132.03 42.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.834 -0.621 . . . . 63.32 110.16 179.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.4 t -142.99 170.96 14.72 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.917 -0.401 . . . . 74.299999999999997 109.917 176.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.638 ' HA ' ' HA ' ' A' ' 67' ' ' PRO . 4.2 p-10 -116.67 9.63 14.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.347 0.594 . . . . 64.329999999999998 110.008 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -117.09 128.37 55.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.539 -0.755 . . . . 71.349999999999994 111.266 -175.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.703 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -77.54 -21.07 53.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.819 -0.628 . . . . 54.409999999999997 111.705 -176.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.7 t -69.18 -49.39 62.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.156 0.503 . . . . 65.040000000000006 109.849 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.5 tp -60.91 -37.51 82.52 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.641 -0.709 . . . . 63.340000000000003 110.231 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.703 HD12 ' HA ' ' A' ' 32' ' ' ALA . 78.5 mt -59.34 -35.15 73.32 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.98 -0.555 . . . . 61.299999999999997 111.072 177.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -69.74 -42.54 73.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.4 -0.364 . . . . 71.209999999999994 110.445 179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.498 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.77 -53.17 44.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 63.439999999999998 111.04 179.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.525 HG13 HD21 ' A' ' 84' ' ' LEU . 99.1 t -61.43 -40.57 86.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 121.127 0.489 . . . . 74.230000000000004 110.591 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.4 -48.48 85.97 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.685 -0.689 . . . . 73.209999999999994 111.979 178.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.63 -28.48 69.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 62.439999999999998 111.443 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 88.3 mt -67.13 -51.64 51.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.863 0.364 . . . . 72.049999999999997 110.559 177.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 82.5 mt -72.43 -39.11 68.11 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.98 -0.555 . . . . 75.120000000000005 110.665 -177.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -66.92 -41.2 87.45 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.463 -0.79 . . . . 73.230000000000004 110.666 -178.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -80.08 -11.79 84.03 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.622 -0.799 . . . . 62.549999999999997 112.83 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -102.85 4.22 37.5 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 122.711 -0.288 . . . . 61.240000000000002 111.225 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.4 t70 63.15 32.48 15.11 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.682 0.753 . . . . 71.530000000000001 110.575 178.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 68.6 mt -93.58 130.09 43.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.884 -0.598 . . . . 63.119999999999997 110.308 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.18 117.96 6.59 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.929 -0.578 . . . . 62.32 112.165 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 54.0 p-80 -139.53 142.53 37.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.078 0.466 . . . . 44.340000000000003 110.935 -175.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.0 tp -113.31 115.82 28.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.971 -0.558 . . . . 73.230000000000004 110.824 -176.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.7 m -132.25 136.31 56.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.582 -0.736 . . . . 73.420000000000002 109.753 173.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.401 ' N ' HD12 ' A' ' 52' ' ' LEU . 5.9 mp -104.82 -86.67 0.46 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.288 -0.264 . . . . 74.099999999999994 110.288 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.5 t70 69.34 -174.4 0.19 Allowed 'General case' 0 N--CA 1.466 0.349 0 O-C-N 123.871 0.732 . . . . 72.120000000000005 111.934 173.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 54.3 tp60 -111.3 -30.46 7.42 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.854 -0.612 . . . . 75.010000000000005 110.279 -175.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.406 ' O ' ' HB2' ' A' ' 56' ' ' MET . 4.4 t30 73.32 -44.89 0.6 Allowed 'General case' 0 N--CA 1.473 0.718 0 O-C-N 124.004 0.815 . . . . 65.420000000000002 110.919 -175.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.406 ' HB2' ' O ' ' A' ' 55' ' ' ASN . 24.6 mmt 73.72 160.15 0.23 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.815 0.846 . . . . 62.229999999999997 111.244 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.9 m -83.95 89.47 7.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.427 0.632 . . . . 75.299999999999997 109.336 174.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.5 tt -75.6 135.21 27.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.298 -0.864 . . . . 70.329999999999998 112.199 -171.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 46.1 tp -125.22 -53.54 1.61 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.954 -1.128 . . . . 75.510000000000005 107.954 171.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -121.48 130.41 53.54 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.441 -0.948 . . . . 52.409999999999997 108.441 169.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -112.56 131.66 10.27 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.555 -0.831 . . . . 65.230000000000004 112.809 -175.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 27.2 t -166.74 146.43 5.65 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 110.231 -0.285 . . . . 72.530000000000001 110.231 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.4 mt 65.34 -173.72 0.18 Allowed 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.789 0.681 . . . . 73.319999999999993 111.791 176.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -128.08 118.53 2.87 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.507 -1.037 . . . . 22.109999999999999 110.507 172.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.522 HG23 HG13 ' A' ' 66' ' ' ILE . 25.3 m -104.57 -7.18 9.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 117.012 0.406 . . . . 74.239999999999995 111.553 -175.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.522 HG13 HG23 ' A' ' 65' ' ' VAL . 74.3 mt -122.41 124.41 26.81 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 116.17 -0.468 . . . . 43.350000000000001 110.451 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.638 ' HA ' ' HA ' ' A' ' 30' ' ' ASN . 10.4 Cg_exo -71.7 86.21 0.89 Allowed 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.72 2.28 . . . . 74.5 111.231 174.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.636 ' HB3' HD11 ' A' ' 35' ' ' LEU . 12.7 tpp180 -93.99 135.47 35.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.513 0.673 . . . . 75.310000000000002 110.952 -175.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.478 ' HD2' ' OE1' ' A' ' 25' ' ' GLU . 18.1 ptt180 -119.01 145.97 45.42 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.414 -0.812 . . . . 62.210000000000001 110.122 178.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 40.2 t -105.18 123.3 59.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.859 -0.609 . . . . 61.229999999999997 110.101 -177.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.621 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 9.6 mp -103.88 155.34 18.7 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.402 -0.592 . . . . 75.140000000000001 109.402 175.4 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.4 m -137.82 168.49 20.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-O 120.773 0.32 . . . . 62.130000000000003 110.399 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.424 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 27.6 m80 -73.42 160.51 31.65 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.95 -0.759 . . . . 73.519999999999996 108.95 176.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.32 -11.07 60.54 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.983 0.421 . . . . 72.409999999999997 110.849 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -91.71 -23.18 19.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.031 -0.532 . . . . 75.310000000000002 110.729 174.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.424 ' OD1' ' HB2' ' A' ' 73' ' ' HIS . 9.8 m-20 -93.76 -13.31 27.54 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.873 -0.603 . . . . 73.319999999999993 110.213 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.498 HD23 ' HB2' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -52.74 -57.08 11.29 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.639 -0.71 . . . . 74.420000000000002 111.183 -176.462 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.96 -40.85 97.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.383 -0.371 . . . . 71.109999999999999 111.322 -177.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.8 -46.67 81.41 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.816 -0.706 . . . . 71.120000000000005 112.446 -177.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.51 -41.21 96.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.653 0.263 . . . . 73.310000000000002 111.413 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 14.2 mtp180 -60.47 -53.02 62.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.338 -0.392 . . . . 73.439999999999998 111.241 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 61.9 mtt180 -64.34 -32.62 74.3 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.704 0.261 . . . . 63.100000000000001 111.704 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.3 tp -63.59 -54.65 32.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.783 0.325 . . . . 71.200000000000003 110.707 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.525 HD21 HG13 ' A' ' 38' ' ' VAL . 11.3 mp -65.46 -31.71 72.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 73.540000000000006 111.442 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.727 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 85.7 m -64.31 -46.28 84.25 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.739 0.304 . . . . 44.399999999999999 110.782 178.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -67.73 -29.79 69.11 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.036 0.446 . . . . 71.019999999999996 110.457 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.3 -14.79 60.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.183 -0.462 . . . . 74.230000000000004 111.131 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.64 9.57 66.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.798 -0.715 . . . . 73.099999999999994 112.415 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 79.9 mt -96.88 14.29 25.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.917 0.389 . . . . 71.549999999999997 110.727 -178.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.788 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -71.57 80.6 0.81 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.035 -0.529 . . . . 52.119999999999997 110.668 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -134.96 -58.12 0.81 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.939 -0.573 . . . . 64.329999999999998 109.883 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' A' ' 94' ' ' ARG . 77.0 mm-40 -90.67 7.84 37.4 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.221 -0.445 . . . . 74.299999999999997 111.751 -178.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.788 HD13 ' HA ' ' A' ' 90' ' ' ALA . 10.8 mp -61.29 118.94 7.55 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.811 -0.44 . . . . 71.129999999999995 109.811 176.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.535 ' HG3' ' O ' ' A' ' 92' ' ' GLU . 58.0 mtt180 -121.34 135.58 55.07 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.566 0.698 . . . . 75.329999999999998 112.417 -172.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.7 m -156.48 81.12 0.97 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 107.595 -1.261 . . . . 70.409999999999997 107.595 173.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -85.65 126.39 33.89 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.797 -0.638 . . . . 63.350000000000001 111.63 -168.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.354 -0.831 . . . . 74.329999999999998 109.048 175.558 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.1 tpt . . . . . 0 N--CA 1.479 1.024 0 CA-C-O 120.883 0.373 . . . . 64.310000000000002 110.416 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.02 130.16 5.36 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.868 -0.682 . . . . 63.310000000000002 111.879 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 37.0 p -121.69 -171.81 2.3 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.937 -0.394 . . . . 73.319999999999993 109.937 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.7 t -143.02 130.81 21.48 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.877 -0.416 . . . . 60.439999999999998 109.877 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.3 m170 -75.86 140.29 42.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.274 -0.421 . . . . 74.120000000000005 110.058 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.5 p-80 -88.34 124.01 33.49 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.922 0.392 . . . . 73.329999999999998 111.275 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -146.55 166.3 26.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.01 -0.541 . . . . 74.129999999999995 110.355 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.1 p-80 -170.45 152.59 4.02 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.372 -0.603 . . . . 71.340000000000003 109.372 175.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -151.09 126.7 10.17 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.205 0.526 . . . . 73.019999999999996 111.801 -178.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -135.02 136.39 42.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.677 -0.692 . . . . 73.439999999999998 109.538 172.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 16.8 m -126.9 107.21 9.89 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.848 0.356 . . . . 73.230000000000004 110.579 -178.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.0 m -110.66 112.3 24.09 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.153 -0.476 . . . . 73.299999999999997 110.531 -179.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 155.63 142.43 3.43 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.506 -0.854 . . . . 74.510000000000005 112.816 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 14' ' ' ARG . 37.3 ttm180 -129.53 134.33 47.71 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.661 -0.496 . . . . 75.120000000000005 109.661 175.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -140.33 94.72 2.77 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.048 0.451 . . . . 75.430000000000007 110.922 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -135.97 17.16 3.26 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.078 -0.51 . . . . 72.219999999999999 110.615 177.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 39.6 tp -76.37 136.46 39.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.272 -0.422 . . . . 71.150000000000006 110.118 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 74.2 -13.71 0.76 Allowed 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.896 0.747 . . . . 75.120000000000005 111.535 -178.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -70.86 -36.55 72.87 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.442 -0.577 . . . . 73.209999999999994 109.442 174.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -67.47 118.86 11.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.05 -0.977 . . . . 60.109999999999999 110.717 176.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 177.68 -18.73 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.691 -0.766 . . . . 70.5 113.214 177.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -122.19 -136.28 0.31 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 117.254 0.527 . . . . 73.519999999999996 110.249 -175.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.623 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . 6.0 mp -125.09 144.75 50.26 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.709 -0.478 . . . . 75.019999999999996 109.709 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.415 ' HG2' ' HG2' ' A' ' 74' ' ' GLU . 22.9 mmt180 -123.98 155.03 38.96 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.889 -0.411 . . . . 71.030000000000001 109.889 -178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -62.67 111.29 2.02 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 121.201 0.524 . . . . 73.099999999999994 110.813 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 39.6 tp -80.99 -23.03 39.01 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.166 -0.925 . . . . 72.109999999999999 108.809 175.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.506 ' HA ' ' HA ' ' A' ' 94' ' ' ARG . 0.7 OUTLIER 179.18 162.17 0.8 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.011 -0.995 . . . . 64.010000000000005 109.524 176.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -149.19 147.53 28.54 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.467 -0.568 . . . . 72.129999999999995 109.467 -179.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.411 HG22 HD21 ' A' ' 35' ' ' LEU . 13.4 t -170.1 169.36 7.99 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.979 0.419 . . . . 61.399999999999999 110.56 178.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -97.08 -8.8 29.38 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.909 -0.587 . . . . 74.450000000000003 110.678 179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -82.28 148.54 28.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.375 -0.375 . . . . 74.329999999999998 110.625 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.63 -9.8 14.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.52 -0.309 . . . . 60.329999999999998 111.514 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.1 t -79.05 -43.53 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.289 0.566 . . . . 74.420000000000002 111.012 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.606 HD21 HD13 ' A' ' 89' ' ' LEU . 39.5 tp -70.1 -41.05 74.52 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.805 -0.634 . . . . 50.140000000000001 110.741 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.453 ' CD1' ' HB3' ' A' ' 68' ' ' ARG . 68.2 mt -64.87 -36.2 83.57 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.126 0.417 . . . . 73.329999999999998 112.126 -174.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.0 p -66.76 -29.7 69.73 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.99 0.424 . . . . 63.439999999999998 110.575 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.4 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.38 -42.95 61.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.207 -0.452 . . . . 74.349999999999994 110.108 176.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.51 HG23 ' O ' ' A' ' 34' ' ' LEU . 61.6 t -57.3 -41.97 79.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.716 -0.675 . . . . 74.329999999999998 110.408 176.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -56.61 -50.59 62.12 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.41 -0.814 . . . . 74.430000000000007 112.305 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -58.94 -34.29 71.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.74 0.305 . . . . 73.0 111.406 -178.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 83.5 mt -67.19 -46.46 73.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.111 0.482 . . . . 72.439999999999998 110.174 178.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.9 mt -69.12 -31.69 70.55 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.879 -0.601 . . . . 72.209999999999994 111.162 -179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -71.07 -38.72 72.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.266 -0.425 . . . . 61.009999999999998 110.081 175.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.01 -43.01 94.37 Favored Glycine 0 C--N 1.332 0.338 0 CA-C-N 115.956 -0.566 . . . . 50.329999999999998 112.452 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.4 -10.18 59.3 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.874 0.369 . . . . 72.409999999999997 110.66 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t70 61.92 34.65 16.75 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.386 -0.824 . . . . 73.340000000000003 110.906 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.2 mt -85.13 -29.35 6.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.724 0.773 . . . . 55.43 109.568 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.6 169.65 37.17 Favored Glycine 0 N--CA 1.447 -0.613 0 CA-C-N 114.987 -1.006 . . . . 44.100000000000001 111.595 -177.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -160.93 137.78 8.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.961 0.41 . . . . 52.25 111.954 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 2.8 tm? -109.75 103.25 12.05 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 107.755 -1.202 . . . . 51.520000000000003 107.755 168.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.597 HG12 HG22 ' A' ' 70' ' ' VAL . 3.1 m -119.53 87.84 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.516 0.674 . . . . 63.25 111.493 -174.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 97.4 mt -128.82 162.14 28.17 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.367 -0.833 . . . . 62.450000000000003 110.336 -179.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.494 ' HA ' ' HA ' ' A' ' 68' ' ' ARG . 4.4 p-10 -95.27 -97.95 0.17 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.398 -0.365 . . . . 73.140000000000001 111.616 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.846 HE21 ' HA ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -113.62 -84.03 0.6 Allowed 'General case' 0 C--N 1.327 -0.376 0 O-C-N 122.199 -0.313 . . . . 75.150000000000006 111.654 -175.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -167.12 157.56 11.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.432 -0.349 . . . . 73.409999999999997 110.563 -173.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 16.5 tpt -105.87 116.0 31.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.196 -0.456 . . . . 61.509999999999998 110.365 178.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 57.9 m -153.67 122.89 6.54 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.172 -0.467 . . . . 73.129999999999995 110.066 177.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 6.9 tp -72.58 109.68 4.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.727 0.775 . . . . 63.329999999999998 111.114 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 55.6 tp -140.63 155.14 46.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.581 -0.736 . . . . 73.25 109.109 178.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -73.7 107.0 5.7 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.641 0.734 . . . . 65.109999999999999 110.702 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 169.27 147.83 5.58 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.418 -1.073 . . . . 30.030000000000001 110.418 -178.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 m -87.33 -26.93 23.14 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.964 0.382 . . . . 72.340000000000003 111.186 -177.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.447 ' HB3' ' H ' ' A' ' 64' ' ' GLY . 10.1 mp 61.74 -157.06 0.34 Allowed 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.188 -0.46 . . . . 75.530000000000001 110.37 -178.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.447 ' H ' ' HB3' ' A' ' 63' ' ' LEU . . . 156.99 -30.76 0.54 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.474 -0.869 . . . . 73.510000000000005 112.562 177.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 47.5 t -81.88 106.7 13.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.918 0.389 . . . . 61.240000000000002 110.371 -179.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 49.9 mm -119.22 91.86 44.54 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 116.143 -0.48 . . . . 72.530000000000001 110.257 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -95.1 99.82 0.11 Allowed 'Trans proline' 0 N--CA 1.447 -1.23 0 C-N-CA 123.238 2.625 . . . . 71.099999999999994 111.536 176.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.494 ' HA ' ' HA ' ' A' ' 53' ' ' ASP . 55.8 ttm-85 -89.32 136.31 33.09 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.908 -0.404 . . . . 73.239999999999995 109.908 -178.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.99 141.94 46.26 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.239 -0.437 . . . . 51.439999999999998 110.362 -179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.597 HG22 HG12 ' A' ' 51' ' ' VAL . 48.1 t -102.38 106.94 20.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.663 -0.699 . . . . 74.510000000000005 109.838 177.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.623 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 10.3 mp -106.12 132.86 51.69 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.901 0.382 . . . . 62.350000000000001 111.103 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.3 m -120.77 155.25 24.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.307 -0.627 . . . . 65.030000000000001 109.307 173.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.434 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 7.5 t-80 -64.37 144.79 56.91 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.893 -0.41 . . . . 61.100000000000001 109.893 -178.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.528 ' HA ' HD23 ' A' ' 77' ' ' LEU . 42.6 mt-10 -71.6 69.23 0.62 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.299 0.571 . . . . 72.25 111.864 -176.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -141.98 -51.53 0.41 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.2 -0.909 . . . . 70.019999999999996 109.477 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -108.88 43.73 1.22 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.425 -0.807 . . . . 74.25 111.733 -177.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 74' ' ' GLU . 4.1 mm? -65.18 -52.89 52.13 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.712 -0.477 . . . . 61.009999999999998 109.712 175.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.9 -22.64 62.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.203 -0.453 . . . . 73.239999999999995 110.942 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.24 -48.05 15.92 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 121.04 -0.6 . . . . 75.120000000000005 112.017 177.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.04 -38.62 86.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.776 0.322 . . . . 60.109999999999999 110.467 177.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.45 HH11 ' HD2' ' A' ' 81' ' ' ARG . 21.0 mtp180 -62.1 -28.23 69.47 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.119 -0.491 . . . . 71.450000000000003 110.406 175.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.7 tpp85 -69.8 -51.1 36.69 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.497 -0.557 . . . . 73.409999999999997 109.497 176.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.3 tp -60.01 -51.65 68.75 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.113 -0.949 . . . . 62.509999999999998 111.631 -177.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.0 mp -63.05 -27.58 69.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 73.329999999999998 111.844 -176.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.889 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 70.1 m -81.45 -43.24 19.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.824 0.345 . . . . 73.340000000000003 111.08 179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -67.69 -44.14 78.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 71.310000000000002 110.881 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.09 87.86 1.22 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.227 -0.442 . . . . 73.150000000000006 110.717 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -172.47 -69.43 0.04 OUTLIER Glycine 0 N--CA 1.442 -0.931 0 C-N-CA 120.447 -0.883 . . . . 33.530000000000001 111.987 176.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.692 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -164.12 -56.65 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.637 0.256 . . . . 74.400000000000006 110.937 -175.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.889 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 60.6 13.37 4.19 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.72 -0.673 . . . . 71.340000000000003 112.168 -177.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -87.23 -40.99 14.04 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 121.131 -0.227 . . . . 72.140000000000001 110.992 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -93.5 -81.61 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.997 -0.281 . . . . 72.349999999999994 111.228 -177.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 96.1 mt 53.48 43.59 31.08 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.743 0.782 . . . . 71.310000000000002 109.521 -172.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.506 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 49.6 ttt180 64.31 89.15 0.09 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 113.693 -1.594 . . . . 62.0 111.048 -173.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 19.4 m -74.76 89.15 2.28 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.732 -0.84 . . . . 62.240000000000002 108.732 170.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -82.65 88.16 6.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.574 -0.739 . . . . 73.409999999999997 110.147 -173.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.7 t70 . . . . . 0 C--O 1.247 0.932 0 CA-C-N 115.35 -0.841 . . . . 75.420000000000002 110.318 -174.797 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.736 0.303 . . . . 73.150000000000006 110.326 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.12 100.41 0.29 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.784 -0.722 . . . . 70.209999999999994 112.542 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.7 t -84.8 127.68 34.25 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.312 -0.625 . . . . 73.420000000000002 109.312 177.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.6 p -120.33 101.09 7.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.203 0.525 . . . . 54.439999999999998 111.061 -178.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -158.81 118.91 3.17 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.702 -0.681 . . . . 44.119999999999997 110.617 177.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -149.98 115.86 5.62 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.537 -0.912 . . . . 62.439999999999998 108.537 176.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -93.41 106.21 18.2 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.389 -0.369 . . . . 70.239999999999995 110.689 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 24.1 p-80 -104.57 113.63 27.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.421 0.629 . . . . 70.409999999999997 110.936 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -149.37 108.03 3.83 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.592 -0.731 . . . . 73.519999999999996 109.918 174.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -160.72 125.9 3.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.135 -0.484 . . . . 63.140000000000001 110.515 -177.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.4 p -155.27 86.41 1.09 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.026 -0.533 . . . . 72.239999999999995 110.281 177.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.5 m -152.46 124.81 8.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.169 -0.469 . . . . 74.519999999999996 110.79 178.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 140.56 97.33 0.32 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.966 -0.635 . . . . 61.140000000000001 112.285 176.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.7 ttp180 -106.73 -41.1 5.32 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.496 -0.557 . . . . 71.040000000000006 109.496 177.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 65.72 92.24 0.08 Allowed 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.364 -0.835 . . . . 62.520000000000003 111.908 175.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -143.58 -47.1 0.29 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.931 -0.577 . . . . 75.329999999999998 110.894 178.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -90.8 122.56 33.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.142 -0.481 . . . . 71.209999999999994 110.188 -174.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -80.15 97.4 6.87 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.838 -0.619 . . . . 74.340000000000003 110.564 178.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -84.81 170.31 13.3 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.079 -0.51 . . . . 62.509999999999998 110.714 179.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.432 ' HG2' ' H ' ' A' ' 22' ' ' HIS . 32.8 tt0 -99.97 119.6 38.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.091 0.472 . . . . 61.5 111.092 -175.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -89.67 26.92 8.52 Favored Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.755 -0.736 . . . . 61.450000000000003 112.25 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.444 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 17.9 t-80 -94.01 -10.65 32.88 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.744 0.307 . . . . 52.32 110.228 179.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 22' ' ' HIS . 8.7 mp 71.93 151.14 0.1 Allowed 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.525 -0.761 . . . . 75.219999999999999 111.783 178.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 43.9 mtt180 -125.36 166.04 17.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.459 -0.791 . . . . 71.519999999999996 109.162 175.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.803 ' HG2' ' HD2' ' A' ' 69' ' ' ARG . 2.0 mp0 -77.92 124.25 27.77 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 109.284 -0.635 . . . . 64.340000000000003 109.284 171.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.521 ' HB3' HD23 ' A' ' 27' ' ' LEU . 1.1 tm? -77.17 -30.73 55.03 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 108.801 -0.814 . . . . 74.5 108.801 177.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.521 HD23 ' HB3' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -170.08 160.53 8.17 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.563 -0.744 . . . . 73.230000000000004 110.84 -175.197 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.513 ' HD3' ' HB3' ' A' ' 67' ' ' PRO . 6.0 tmm_? -127.56 106.48 9.2 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 107.0 -1.481 . . . . 74.439999999999998 107.0 170.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.5 HG21 HD21 ' A' ' 35' ' ' LEU . 14.6 t -78.25 164.2 25.1 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.482 0.658 . . . . 72.230000000000004 111.573 -166.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -114.7 -3.5 12.84 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.159 -0.928 . . . . 55.5 110.397 178.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -131.93 147.2 52.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.504 -0.316 . . . . 44.450000000000003 110.995 -175.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -93.74 -23.35 18.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.346 -0.388 . . . . 63.229999999999997 111.532 -175.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.0 t -79.18 -37.78 19.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.319 0.58 . . . . 71.099999999999994 110.0 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.3 tp -57.03 -32.25 65.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.413 -0.812 . . . . 72.099999999999994 111.284 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.5 HD21 HG21 ' A' ' 29' ' ' THR . 93.5 mt -56.08 -39.6 72.34 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.944 0.402 . . . . 74.409999999999997 111.446 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.4 m -64.95 -26.85 68.48 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.886 -0.597 . . . . 51.409999999999997 110.895 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.21 -47.9 10.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.267 -0.424 . . . . 55.229999999999997 110.639 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.429 ' HA ' HD12 ' A' ' 41' ' ' LEU . 86.4 t -58.58 -40.54 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 CA-C-N 116.163 -0.472 . . . . 73.310000000000002 111.416 -179.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.03 -50.03 72.09 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 121.025 -0.607 . . . . 73.099999999999994 112.553 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.41 -27.22 69.15 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.895 0.378 . . . . 71.209999999999994 111.295 -177.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.443 ' HB3' HD21 ' A' ' 83' ' ' LEU . 91.9 mt -69.82 -51.66 31.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.966 -0.561 . . . . 75.25 110.168 177.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.4 mt -65.44 -40.21 93.02 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.669 -0.696 . . . . 45.310000000000002 110.919 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -64.63 -47.56 78.11 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.993 0.425 . . . . 72.340000000000003 110.662 177.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.09 -25.75 75.18 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.984 -0.627 . . . . 44.340000000000003 113.058 -176.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.74 1.63 56.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.681 0.241 . . . . 51.240000000000002 111.46 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.2 t70 64.86 33.19 10.28 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 122.001 0.905 . . . . 71.25 110.287 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.803 HG23 ' HB3' ' A' ' 76' ' ' ASP . 71.5 mt -88.25 128.27 40.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.353 -0.839 . . . . 73.040000000000006 110.394 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -72.69 99.16 0.9 Allowed Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.812 -0.515 . . . . 44.109999999999999 111.812 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 50.3 p-80 -122.7 152.52 40.48 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.778 0.323 . . . . 70.010000000000005 110.887 -173.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 50.0 tp -129.03 104.8 7.78 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.873 -0.603 . . . . 43.43 110.159 177.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.3 m -129.63 112.29 24.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.095 -0.502 . . . . 65.450000000000003 110.708 177.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.41 HD12 ' O ' ' A' ' 52' ' ' LEU . 2.7 pp -147.2 149.56 33.18 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.339 -0.392 . . . . 62.32 111.266 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -179.36 -160.7 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.127 -1.064 . . . . 74.319999999999993 108.127 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -122.63 127.86 49.91 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.888 -0.412 . . . . 73.109999999999999 109.888 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -78.16 137.44 38.17 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.43 -0.581 . . . . 75.230000000000004 109.43 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 54.6 ttp -49.56 -70.4 0.09 Allowed 'General case' 0 C--N 1.332 -0.177 0 O-C-N 123.713 0.633 . . . . 61.420000000000002 110.994 -178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.6 t 174.45 151.71 0.1 Allowed 'General case' 0 C--N 1.326 -0.433 0 O-C-N 123.879 0.737 . . . . 74.129999999999995 109.4 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 14.3 tt -90.34 -13.93 9.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.64 0.733 . . . . 75.209999999999994 109.117 172.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 63.5 tp -101.57 98.9 9.16 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.332 -0.849 . . . . 73.230000000000004 110.333 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 68.34 -166.88 0.19 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.315 -0.857 . . . . 71.340000000000003 111.245 176.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.34 128.28 6.33 Favored Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.247 -0.741 . . . . 73.519999999999996 111.247 -174.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 31.5 m -72.09 -74.45 0.16 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.75 0.275 . . . . 71.25 111.004 -175.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 80.2 mt -135.29 119.0 17.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.923 0.392 . . . . 71.049999999999997 110.717 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.3 71.68 1.38 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.932 -0.652 . . . . 63.210000000000001 111.916 178.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 40.5 t -81.29 84.36 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 121.175 0.512 . . . . 64.150000000000006 110.743 -178.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 mp -110.79 112.47 56.02 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.694 -0.685 . . . . 64.420000000000002 109.588 176.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.513 ' HB3' ' HD3' ' A' ' 28' ' ' ARG . 22.3 Cg_exo -64.96 108.2 1.06 Allowed 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.579 2.186 . . . . 72.340000000000003 111.308 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.534 ' HA ' ' CZ ' ' A' ' 68' ' ' ARG . 0.7 OUTLIER -97.35 138.11 35.31 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.219 -0.446 . . . . 74.230000000000004 110.723 -177.305 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.803 ' HD2' ' HG2' ' A' ' 25' ' ' GLU . 81.9 mtm180 -113.55 133.54 55.2 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.994 -0.548 . . . . 71.109999999999999 109.865 178.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 60.2 t -103.62 114.93 44.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.518 -0.549 . . . . 73.310000000000002 109.518 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.481 HD11 ' HG3' ' A' ' 25' ' ' GLU . 10.1 mp -103.59 144.18 31.77 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.851 0.358 . . . . 72.200000000000003 111.143 -177.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.504 HG23 HD22 ' A' ' 77' ' ' LEU . 26.2 m -141.5 167.27 16.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.682 -0.69 . . . . 75.450000000000003 109.811 176.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.505 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 14.1 m-70 -74.8 162.87 28.28 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.21 -0.663 . . . . 74.340000000000003 109.21 176.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.514 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 17.5 mt-10 -71.17 -18.62 62.48 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.214 -0.662 . . . . 74.409999999999997 109.214 174.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -66.87 -37.79 85.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.266 -0.879 . . . . 72.230000000000004 109.624 172.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.803 ' HB3' HG23 ' A' ' 47' ' ' ILE . 8.5 m-20 -97.45 -4.86 37.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.057 -0.974 . . . . 61.310000000000002 110.505 -175.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.612 ' O ' ' HG3' ' A' ' 81' ' ' ARG . 0.1 OUTLIER -53.24 -58.26 7.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.837 -0.62 . . . . 73.219999999999999 111.233 -172.1 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.84 -32.72 72.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.801 0.334 . . . . 54.109999999999999 111.232 -177.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.76 -47.17 91.17 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 120.81 -0.709 . . . . 62.43 112.055 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.58 -40.8 80.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.504 0.193 . . . . 55.210000000000001 110.837 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.612 ' HG3' ' O ' ' A' ' 77' ' ' LEU . 21.0 mtp180 -57.36 -53.88 53.13 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-N 116.416 -0.357 . . . . 74.439999999999998 110.969 -179.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -67.24 -37.55 83.71 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.833 -0.347 . . . . 64.019999999999996 110.864 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.443 HD21 ' HB3' ' A' ' 41' ' ' LEU . 60.6 tp -58.89 -54.94 41.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.072 0.463 . . . . 64.310000000000002 110.773 179.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.9 mt -66.09 -27.62 68.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.794 -0.639 . . . . 71.340000000000003 111.724 -178.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.75 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 69.0 m -79.37 -42.7 24.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.768 0.318 . . . . 42.43 111.0 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.96 -43.91 70.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.997 -0.547 . . . . 60.030000000000001 112.261 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -132.49 23.72 4.39 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.397 0.517 . . . . 43.210000000000001 112.397 -175.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -121.01 -84.01 0.76 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.03 -1.081 . . . . 73.5 111.517 176.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.524 HD12 ' N ' ' A' ' 90' ' ' ALA . 0.8 OUTLIER -178.35 -31.84 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.48 -0.36 . . . . 70.120000000000005 111.514 -175.832 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.75 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 59.36 24.58 13.16 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.818 0.342 . . . . 72.510000000000005 111.686 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.458 ' H ' ' CD1' ' A' ' 89' ' ' LEU . 45.0 t60 -89.98 -22.76 21.76 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.337 -0.392 . . . . 71.129999999999995 111.164 -175.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -92.69 -8.32 44.3 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.291 -0.413 . . . . 43.130000000000003 111.686 -173.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.692 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.5 mp -70.42 94.59 0.97 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.148 0.499 . . . . 73.040000000000006 110.696 -176.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -137.7 27.45 2.74 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.757 -0.656 . . . . 74.430000000000007 111.739 -174.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 38.2 m -132.88 20.52 4.15 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.295 0.569 . . . . 45.109999999999999 110.893 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -92.45 116.5 29.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.717 -0.674 . . . . 64.400000000000006 111.055 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 24.6 t70 . . . . . 0 C--O 1.251 1.166 0 CA-C-N 115.817 -0.628 . . . . 75.200000000000003 109.866 176.438 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 mmt . . . . . 0 N--CA 1.482 1.139 0 CA-C-O 120.695 0.284 . . . . 52.329999999999998 110.263 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 118.91 112.81 2.49 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.882 -0.675 . . . . 71.049999999999997 112.128 179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.7 t -128.96 95.74 4.16 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.981 0.42 . . . . 72.129999999999995 109.951 179.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.0 m -147.84 147.9 30.29 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.653 -0.703 . . . . 73.400000000000006 109.669 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -137.37 105.68 5.76 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.297 0.57 . . . . 73.409999999999997 110.698 178.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -102.62 119.59 39.09 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.781 -0.645 . . . . 74.519999999999996 109.868 177.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -71.9 87.84 1.02 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.21 -0.45 . . . . 70.400000000000006 110.064 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -75.99 150.3 37.45 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.065 -0.516 . . . . 73.319999999999993 110.851 -178.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -171.2 101.83 0.21 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.127 -0.488 . . . . 71.409999999999997 110.182 176.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.5 m80 -100.03 152.55 20.08 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.184 -0.462 . . . . 65.120000000000005 110.034 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.2 p -84.87 164.63 18.29 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.348 -0.387 . . . . 75.129999999999995 110.792 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.3 m -114.22 121.18 42.93 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.918 0.39 . . . . 62.109999999999999 110.505 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -170.56 103.41 0.19 Allowed Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.294 -0.722 . . . . 44.109999999999999 111.294 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 25.8 ptt180 -119.17 141.64 48.67 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.933 0.397 . . . . 74.329999999999998 110.919 -176.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -139.39 121.58 15.85 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.784 -0.644 . . . . 75.109999999999999 109.594 178.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -150.68 94.6 2.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.458 -0.337 . . . . 72.239999999999995 110.889 -176.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 6.0 mp -135.58 91.68 2.74 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.35 -0.386 . . . . 73.420000000000002 110.755 179.391 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -105.41 109.7 21.77 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.34 -0.615 . . . . 75.25 109.34 172.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.8 m-85 -66.89 -55.17 15.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.198 -0.455 . . . . 71.319999999999993 111.256 -174.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -107.86 134.4 50.85 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.878 0.37 . . . . 72.439999999999998 110.794 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.34 64.48 0.28 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 121.015 -0.612 . . . . 61.149999999999999 112.003 -179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -130.17 57.69 1.69 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.104 -0.702 . . . . 63.130000000000003 109.104 178.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.1 mt 67.99 168.12 0.26 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.169 -0.923 . . . . 51.329999999999998 110.508 -175.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.7 ' HB3' HD23 ' A' ' 77' ' ' LEU . 0.6 OUTLIER -143.84 127.19 16.77 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.766 -0.457 . . . . 74.319999999999993 109.766 -178.63 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.728 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 24.8 tt0 -68.38 117.87 10.72 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.096 -0.502 . . . . 74.540000000000006 109.646 178.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.729 HD12 HD23 ' A' ' 27' ' ' LEU . 2.7 tm? -93.64 -61.18 1.6 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.233 -0.44 . . . . 74.219999999999999 111.292 -171.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.729 HD23 HD12 ' A' ' 26' ' ' LEU . 2.6 pp -142.25 161.7 37.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.779 0.323 . . . . 62.219999999999999 111.063 -173.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.44 ' O ' ' HB3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -134.94 135.87 41.84 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.686 -0.688 . . . . 70.329999999999998 110.038 178.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.4 t -144.61 176.41 9.43 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.019 0.438 . . . . 62.219999999999999 110.943 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -117.72 -11.31 10.39 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.982 -0.553 . . . . 75.329999999999998 110.103 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.484 ' HA ' HD11 ' A' ' 63' ' ' LEU . 19.0 t70 -102.61 153.96 19.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.753 -0.658 . . . . 72.140000000000001 110.768 -176.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -111.59 -11.28 14.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.252 -0.431 . . . . 54.240000000000002 111.239 -178.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 49.9 t -78.52 -43.93 26.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.918 0.39 . . . . 73.140000000000001 110.482 -178.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.663 HD21 HD13 ' A' ' 89' ' ' LEU . 66.1 tp -60.32 -31.6 70.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.891 -0.595 . . . . 73.120000000000005 110.797 177.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 77.6 mt -62.4 -22.64 66.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.583 -0.735 . . . . 70.400000000000006 111.754 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 38.3 m -60.83 -45.03 96.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.846 0.355 . . . . 53.140000000000001 110.362 177.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.518 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -68.06 -41.61 81.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.289 -0.414 . . . . 72.299999999999997 110.616 178.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 56.8 t -60.02 -45.35 95.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.94 -0.573 . . . . 73.230000000000004 110.27 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.44 -44.62 96.47 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.602 -0.726 . . . . 63.140000000000001 112.151 -179.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.36 -33.62 72.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.852 0.358 . . . . 51.509999999999998 110.986 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 91.2 mt -72.09 -47.77 48.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.13 -0.486 . . . . 62.140000000000001 110.7 178.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 91.4 mt -65.72 -47.42 75.39 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.113 -0.494 . . . . 60.43 110.809 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -42.27 98.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 74.319999999999993 110.836 178.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.32 -35.56 87.95 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.231 -0.509 . . . . 71.450000000000003 112.868 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.84 -0.01 55.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.619 0.247 . . . . 72.519999999999996 111.095 179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.5 t70 61.38 35.76 17.74 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.999 0.904 . . . . 65.439999999999998 110.232 -179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.672 HG23 ' HB3' ' A' ' 76' ' ' ASP . 64.9 mt -88.8 119.73 36.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.156 -0.929 . . . . 74.030000000000001 110.57 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.82 137.0 46.98 Favored Glycine 0 C--N 1.332 0.307 0 N-CA-C 111.528 -0.629 . . . . 61.229999999999997 111.528 175.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 38.9 p-80 -152.56 138.57 18.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.114 0.483 . . . . 73.540000000000006 111.68 -171.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.0 tt -126.87 103.93 7.77 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.503 -0.771 . . . . 34.549999999999997 109.163 177.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.4 t -80.86 117.85 27.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.85 -0.426 . . . . 63.140000000000001 109.85 177.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.423 ' HB3' ' HG3' ' A' ' 69' ' ' ARG . 5.9 tt -93.2 100.67 13.0 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.192 0.52 . . . . 71.549999999999997 110.243 -177.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -127.62 162.5 26.35 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.511 -0.922 . . . . 72.010000000000005 108.511 171.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.639 ' H ' HG21 ' A' ' 66' ' ' ILE . 26.2 tt0 -119.63 96.25 5.12 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.033 0.444 . . . . 73.010000000000005 110.4 -177.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -88.8 97.08 10.95 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.047 -0.524 . . . . 60.340000000000003 109.78 179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 85.2 mtp -91.1 -169.99 2.52 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.829 -0.623 . . . . 54.020000000000003 110.456 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.1 m -61.04 156.29 18.23 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.789 -0.448 . . . . 71.329999999999998 109.789 174.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 7.1 tp -60.14 114.63 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.384 0.611 . . . . 64.319999999999993 111.275 -175.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 51.5 tp -151.69 155.06 37.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.503 -0.771 . . . . 51.450000000000003 109.003 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -66.87 126.86 30.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.1 0.476 . . . . 72.409999999999997 111.027 179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.52 100.09 2.4 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.814 -0.707 . . . . 74.310000000000002 112.255 178.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.477 ' HA ' HD13 ' A' ' 66' ' ' ILE . 47.3 t -129.8 -46.92 1.15 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.866 0.365 . . . . 72.439999999999998 110.429 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.484 HD11 ' HA ' ' A' ' 31' ' ' ASP . 24.9 tp -86.71 125.97 34.25 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.544 -0.539 . . . . 75.420000000000002 109.544 -178.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.82 -45.53 3.49 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.938 -0.649 . . . . 71.510000000000005 111.908 -176.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.3 t -62.15 -36.04 72.19 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-O 121.178 0.513 . . . . 63.240000000000002 110.872 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.639 HG21 ' H ' ' A' ' 54' ' ' GLN . 3.5 mp -111.8 111.08 54.27 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 115.795 -0.639 . . . . 54.409999999999997 109.506 173.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -65.09 132.57 32.37 Favored 'Trans proline' 0 N--CA 1.463 -0.269 0 C-N-CA 122.518 2.145 . . . . 73.450000000000003 112.0 179.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 29.0 mmt-85 -101.84 113.33 26.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.192 -0.458 . . . . 75.519999999999996 109.838 -178.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.423 ' HG3' ' HB3' ' A' ' 52' ' ' LEU . 29.6 ptt180 -124.93 142.31 51.55 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.223 -0.591 . . . . 71.439999999999998 110.934 176.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 23.8 t -108.85 125.35 65.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.593 -0.73 . . . . 55.119999999999997 110.756 -174.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.728 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.0 mp -106.23 142.76 35.39 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.546 -0.538 . . . . 72.030000000000001 109.546 174.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 17.8 m -132.12 -178.41 2.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 109.847 -0.427 . . . . 55.149999999999999 109.847 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.587 ' HB2' ' HB2' ' A' ' 76' ' ' ASP . 24.9 m170 -68.49 158.12 34.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.817 0.341 . . . . 73.510000000000005 110.724 177.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -67.63 -38.78 84.39 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.221 -0.659 . . . . 73.030000000000001 109.221 174.482 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -73.4 -39.93 64.7 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.972 -1.013 . . . . 73.120000000000005 110.855 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.672 ' HB3' HG23 ' A' ' 47' ' ' ILE . 9.7 m-20 -78.34 -8.91 58.97 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.8 -0.636 . . . . 44.409999999999997 111.132 -178.391 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.757 HD12 ' HD3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -54.51 -46.2 73.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.041 0.448 . . . . 63.310000000000002 109.864 179.328 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.59 -36.64 79.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.506 -0.77 . . . . 63.119999999999997 111.357 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -78.49 -46.51 8.79 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.365 -0.921 . . . . 72.340000000000003 112.157 -179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.96 -47.9 73.08 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.911 0.337 . . . . 71.530000000000001 111.911 -175.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.757 ' HD3' HD12 ' A' ' 77' ' ' LEU . 15.5 ptt180 -68.56 -22.39 64.49 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.6 -0.44 . . . . 72.450000000000003 110.674 -176.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.4 ttp85 -78.2 -48.72 15.22 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.935 -0.395 . . . . 74.530000000000001 109.935 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 41.4 tp -59.56 -50.36 74.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.602 -0.726 . . . . 52.420000000000002 111.355 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.99 -27.87 68.47 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.929 -0.578 . . . . 73.25 111.917 -177.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.983 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 98.7 m -82.37 -37.35 25.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.791 0.329 . . . . 72.109999999999999 111.277 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -74.42 -44.69 50.73 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.944 0.349 . . . . 50.350000000000001 111.944 -176.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -142.95 35.65 1.39 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 111.851 0.315 . . . . 54.420000000000002 111.851 -174.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -124.63 -79.35 0.39 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.009 -1.091 . . . . 60.409999999999997 112.542 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.681 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.3 OUTLIER -157.62 -56.66 0.08 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.756 0.313 . . . . 64.019999999999996 110.369 -175.099 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.983 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 63.75 12.71 6.87 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.421 -0.809 . . . . 52.340000000000003 112.703 177.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 30.9 t60 -105.39 -26.56 11.91 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.334 -0.547 . . . . 74.319999999999993 111.191 -176.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.44 ' HB3' ' O ' ' A' ' 28' ' ' ARG . 13.5 mm-40 -97.84 -3.21 39.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.087 0.47 . . . . 51.43 110.758 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.697 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.7 mp -73.21 135.31 44.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.148 -0.478 . . . . 62.200000000000003 110.636 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -156.86 91.3 1.2 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.326 0.584 . . . . 75.329999999999998 110.581 -178.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 36.7 m -109.26 64.21 0.61 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.065 -0.717 . . . . 45.450000000000003 109.065 175.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 65.36 14.17 9.27 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.429 -0.805 . . . . 73.439999999999998 110.061 -172.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 19.9 t70 . . . . . 0 C--O 1.25 1.126 0 CA-C-N 114.53 -1.214 . . . . 74.010000000000005 108.938 178.768 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ttt . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 120.889 0.376 . . . . 71.140000000000001 110.22 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 156.49 155.09 7.27 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 111.368 -0.693 . . . . 44.109999999999999 111.368 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 24.5 m -153.49 92.89 1.63 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.96 0.41 . . . . 70.329999999999998 110.639 -178.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.2 p -107.83 66.93 0.67 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.453 0.644 . . . . 50.119999999999997 110.327 178.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -156.14 131.35 9.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.329 -0.85 . . . . 72.519999999999996 109.475 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.7 p-80 -148.36 152.97 37.95 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.53 -0.304 . . . . 70.319999999999993 110.891 -177.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 46.6 t-80 -156.53 81.25 0.96 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.491 -0.559 . . . . 74.049999999999997 109.491 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -154.78 76.69 1.01 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.055 -0.52 . . . . 74.319999999999993 110.475 -175.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -177.11 114.17 0.09 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.349 -0.387 . . . . 61.229999999999997 110.962 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -163.58 17.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.026 0.441 . . . . 74.209999999999994 110.618 170.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.9 m -79.97 106.69 12.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.378 -0.373 . . . . 72.400000000000006 110.433 179.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.0 m -158.07 130.43 7.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.204 -0.453 . . . . 74.340000000000003 110.516 179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 123.62 50.7 0.21 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.223 -0.989 . . . . 55.200000000000003 113.261 175.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -102.09 88.89 3.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.955 0.407 . . . . 75.109999999999999 110.512 174.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -123.62 -5.15 8.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.875 -0.602 . . . . 64.519999999999996 110.662 177.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.415 ' N ' HD22 ' A' ' 16' ' ' ASN . 0.9 OUTLIER -90.29 101.03 13.75 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.285 -0.416 . . . . 73.530000000000001 110.082 176.862 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -134.91 104.27 5.92 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.014 -0.735 . . . . 71.329999999999998 109.014 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 43.3 p90 -148.14 143.77 27.33 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.924 -0.58 . . . . 74.150000000000006 110.123 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.4 p90 -140.74 136.91 33.02 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.931 -0.577 . . . . 71.329999999999998 109.796 176.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -129.0 -34.88 1.88 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.355 0.598 . . . . 72.129999999999995 109.58 178.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.18 26.37 8.36 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.368 -0.833 . . . . 43.310000000000002 111.045 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -113.62 165.12 12.83 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.805 0.336 . . . . 74.439999999999998 110.781 -173.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.4 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.1 mp -99.03 157.85 16.06 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.679 -0.489 . . . . 73.239999999999995 109.679 175.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 ttt180 -134.52 133.31 40.19 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.78 -0.452 . . . . 74.219999999999999 109.78 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.567 ' CA ' ' HG ' ' A' ' 71' ' ' LEU . 1.8 pt-20 -73.28 127.7 33.38 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.097 -0.705 . . . . 71.519999999999996 109.097 -179.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 45.3 tp -104.54 -29.84 10.4 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.579 -0.737 . . . . 65.439999999999998 111.132 -171.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.403 ' CD2' ' HB ' ' A' ' 70' ' ' VAL . 1.6 pt? -163.73 158.67 20.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.045 0.45 . . . . 75.129999999999995 111.253 -176.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -145.8 128.33 16.04 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.567 -0.901 . . . . 73.400000000000006 108.567 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.5 t -143.09 162.15 36.29 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.391 0.615 . . . . 73.040000000000006 111.698 -175.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -106.77 2.03 25.33 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.256 -0.884 . . . . 65.5 110.414 -179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -96.54 119.9 35.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.981 -0.554 . . . . 75.319999999999993 109.822 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.32 -45.94 68.3 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.181 -0.463 . . . . 74.019999999999996 111.981 -174.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 93.2 t -66.51 -46.63 85.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.396 -0.365 . . . . 61.25 111.009 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.8 tp -61.59 -41.5 97.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.766 0.317 . . . . 71.140000000000001 110.396 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.43 HD11 ' HB3' ' A' ' 68' ' ' ARG . 4.7 tt -59.46 -44.55 92.97 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.937 -0.574 . . . . 61.210000000000001 110.011 177.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.8 m -65.31 -41.54 93.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.868 -0.605 . . . . 71.319999999999993 110.711 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.43 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -62.01 -51.87 66.27 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.084 -0.507 . . . . 61.310000000000002 111.087 179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.457 ' HA ' HD12 ' A' ' 41' ' ' LEU . 99.2 t -63.81 -40.46 89.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.089 0.471 . . . . 74.409999999999997 110.927 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.34 -42.24 99.72 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.796 -0.638 . . . . 54.329999999999998 112.297 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.08 -34.03 77.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.805 0.336 . . . . 63.0 110.825 178.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.551 ' HB3' HD21 ' A' ' 83' ' ' LEU . 97.8 mt -62.43 -49.1 76.82 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.285 0.564 . . . . 73.510000000000005 110.5 177.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.539 HD12 HG11 ' A' ' 70' ' ' VAL . 75.3 mt -70.94 -42.53 69.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.578 -0.737 . . . . 63.310000000000002 111.044 -176.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -67.13 -35.53 79.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.953 0.406 . . . . 64.430000000000007 110.627 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.1 -23.05 72.87 Favored Glycine 0 C--O 1.229 -0.194 0 C-N-CA 121.027 -0.606 . . . . 64.129999999999995 112.281 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.19 11.78 20.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.929 0.395 . . . . 33.530000000000001 110.528 177.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.0 t70 68.63 6.26 5.37 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.309 -0.86 . . . . 72.340000000000003 111.294 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 60.6 mt -73.6 -24.19 19.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.648 0.737 . . . . 50.229999999999997 109.042 176.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 71.05 -153.43 51.16 Favored Glycine 0 N--CA 1.441 -1.014 0 CA-C-N 114.779 -1.1 . . . . 55.030000000000001 111.573 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -173.15 143.39 1.12 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.654 0.264 . . . . 75.340000000000003 110.702 176.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.897 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 41.8 tp -108.45 88.28 2.69 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 108.781 -0.822 . . . . 62.210000000000001 108.781 168.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.539 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 24.0 m -108.0 25.21 2.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.974 0.893 . . . . 52.32 109.644 -178.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 39.1 tp -110.94 80.18 1.28 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.817 -1.083 . . . . 72.439999999999998 110.468 -173.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.405 ' HB3' ' H ' ' A' ' 54' ' ' GLN . 0.4 OUTLIER -107.34 -152.52 0.48 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.344 -0.844 . . . . 61.140000000000001 109.713 175.646 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.405 ' H ' ' HB3' ' A' ' 53' ' ' ASP . 58.1 tt0 -64.58 112.52 3.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.071 0.462 . . . . 72.329999999999998 110.996 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -98.86 172.37 7.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.742 -0.663 . . . . 74.219999999999999 110.809 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.437 ' SD ' ' N ' ' A' ' 57' ' ' SER . 0.0 OUTLIER -153.07 161.38 42.56 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.092 -1.077 . . . . 71.030000000000001 108.092 178.793 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.437 ' N ' ' SD ' ' A' ' 56' ' ' MET . 3.8 m -62.01 -82.24 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.871 0.367 . . . . 64.329999999999998 111.31 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.412 ' H ' ' HB2' ' A' ' 57' ' ' SER . 5.3 mp -134.78 -49.91 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.304 -0.407 . . . . 75.329999999999998 109.949 179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.4 tt 59.76 66.41 1.0 Allowed 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.376 -0.829 . . . . 63.229999999999997 110.132 -177.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 71.08 -35.17 0.32 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.741 0.816 . . . . 73.299999999999997 112.805 177.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 87.91 70.43 1.28 Allowed Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.787 -0.72 . . . . 74.219999999999999 111.572 -179.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 39.5 m -148.52 -62.58 0.25 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.818 0.342 . . . . 64.549999999999997 110.705 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 50.8 tp -147.72 145.15 28.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.469 . . . . 74.310000000000002 110.387 -176.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -89.06 131.99 11.0 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.743 -0.741 . . . . 72.319999999999993 111.587 176.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 59.5 t -65.62 -40.85 89.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.387 0.613 . . . . 74.120000000000005 110.262 -179.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 50.4 mm -107.7 103.78 50.58 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.24 -0.891 . . . . 64.010000000000005 109.591 176.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -62.23 124.69 14.8 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.619 2.213 . . . . 72.450000000000003 111.421 177.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.43 ' HB3' HD11 ' A' ' 35' ' ' LEU . 50.3 ttm-85 -62.03 136.91 58.16 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.058 -0.519 . . . . 64.120000000000005 109.997 -178.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 32.0 ptt180 -122.18 157.59 31.23 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.444 -0.343 . . . . 73.030000000000001 110.476 -175.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.539 HG11 HD12 ' A' ' 42' ' ' LEU . 24.7 t -112.53 116.32 52.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.833 -0.621 . . . . 62.210000000000001 110.393 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.897 ' HB2' ' HB3' ' A' ' 50' ' ' LEU . 8.9 mp -101.99 129.58 48.32 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.08 -0.509 . . . . 63.340000000000003 110.288 176.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 29.5 m -108.94 -173.68 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 115.585 -0.734 . . . . 52.229999999999997 109.571 177.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 59.5 m-70 -97.59 143.71 28.0 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.839 -0.344 . . . . 74.019999999999996 110.621 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -40.19 -54.61 2.3 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 114.373 1.249 . . . . 54.43 114.373 -177.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -80.8 -19.07 45.53 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.063 0.458 . . . . 73.450000000000003 111.196 -171.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -83.2 2.24 36.66 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.832 -0.622 . . . . 75.430000000000007 110.783 -177.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -54.89 -44.65 74.31 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.424 -0.353 . . . . 54.240000000000002 110.673 176.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.37 83.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.99 -0.55 . . . . 41.439999999999998 111.177 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -69.1 -46.7 57.48 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.661 -0.781 . . . . 41.310000000000002 111.862 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.3 -40.21 96.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.681 -0.259 . . . . 73.219999999999999 111.582 -178.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 55.2 mtp85 -59.0 -48.64 80.86 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.998 -0.547 . . . . 64.409999999999997 111.357 -178.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -64.58 -45.69 85.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.989 0.423 . . . . 62.049999999999997 110.564 179.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.551 HD21 ' HB3' ' A' ' 41' ' ' LEU . 59.4 tp -55.67 -55.58 30.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.283 -0.872 . . . . 74.120000000000005 111.802 -175.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 68.7 mt -69.21 -32.06 71.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.243 -0.435 . . . . 71.129999999999995 111.745 -176.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 82.5 m -72.35 -44.84 62.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.599 0.238 . . . . 70.109999999999999 111.218 -179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -69.73 -25.65 63.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.032 0.444 . . . . 64.0 110.542 -178.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -81.66 -10.48 59.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.965 -0.562 . . . . 72.109999999999999 110.941 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 72.94 30.35 63.54 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.222 -0.513 . . . . 34.100000000000001 112.73 178.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.4 mt -118.29 17.74 13.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.055 0.455 . . . . 72.340000000000003 111.057 -178.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.632 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -77.83 85.43 4.11 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.252 -0.431 . . . . 60.439999999999998 110.29 178.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -141.18 -40.37 0.39 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.826 -0.624 . . . . 71.109999999999999 110.657 -178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -88.34 -1.28 57.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.463 -0.335 . . . . 73.319999999999993 111.349 -177.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.632 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.1 mp -65.97 118.42 9.74 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.998 -0.371 . . . . 64.310000000000002 109.998 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.54 18.28 15.11 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.718 -0.393 . . . . 73.239999999999995 111.597 -172.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 19.5 m -73.27 -22.81 60.3 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 110.327 -0.249 . . . . 63.039999999999999 110.327 176.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 25.6 t70 75.53 -44.44 0.52 Allowed 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.889 0.876 . . . . 73.209999999999994 111.718 178.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 C--O 1.252 1.184 0 CA-C-O 118.575 -0.726 . . . . 74.540000000000006 109.859 176.346 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.5 ttp . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 110.002 -0.37 . . . . 72.140000000000001 110.002 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -172.46 45.38 0.17 Allowed Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 111.611 -0.596 . . . . 63.229999999999997 111.611 -179.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.6 p -88.07 83.4 7.01 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.214 0.531 . . . . 65.25 111.064 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.2 t -124.2 113.84 18.84 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.108 -0.701 . . . . 62.200000000000003 109.108 179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -104.6 117.25 33.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.507 -0.315 . . . . 70.329999999999998 110.267 -175.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -145.63 105.67 4.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.179 -0.464 . . . . 75.340000000000003 109.862 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -168.23 32.92 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.306 0.575 . . . . 71.519999999999996 109.664 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 -80.66 129.51 34.56 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.774 -0.648 . . . . 70.430000000000007 110.886 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -141.1 107.73 5.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.274 -0.421 . . . . 61.149999999999999 110.754 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.464 ' HA ' ' OD2' ' A' ' 46' ' ' ASP . 55.8 t-80 -60.98 107.67 0.75 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.932 -0.576 . . . . 75.319999999999993 110.799 178.36 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.403 ' H ' ' HB3' ' A' ' 46' ' ' ASP . 16.4 m -116.9 -1.01 12.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.122 0.487 . . . . 54.409999999999997 111.067 -178.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.6 p -87.52 88.99 7.83 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.243 0.544 . . . . 63.149999999999999 110.779 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -122.42 63.9 0.52 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.651 -0.785 . . . . 33.130000000000003 112.844 -177.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -163.03 111.18 1.26 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.982 0.42 . . . . 74.530000000000001 111.742 177.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.19 102.86 8.19 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.416 -0.957 . . . . 63.210000000000001 108.416 169.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.445 ' HB3' HD12 ' A' ' 17' ' ' LEU . 5.2 t-20 -116.2 -21.77 9.21 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.205 -0.452 . . . . 75.420000000000002 111.881 -167.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.445 HD12 ' HB3' ' A' ' 16' ' ' ASN . 5.3 mp -111.46 -158.61 0.65 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.74 -0.467 . . . . 53.409999999999997 109.74 -175.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -162.2 128.36 3.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.247 -0.433 . . . . 74.329999999999998 110.052 173.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.476 ' HD2' ' HB3' ' A' ' 74' ' ' GLU . 85.5 t80 -130.76 134.48 46.92 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.122 -0.49 . . . . 63.43 109.847 177.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -78.55 111.63 14.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.502 0.668 . . . . 62.439999999999998 110.782 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 152.98 -156.68 26.86 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 110.49 -1.044 . . . . 51.119999999999997 110.49 -178.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.476 ' HB3' HD12 ' A' ' 23' ' ' LEU . 35.3 m80 -138.42 -88.09 0.24 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.322 0.561 . . . . 73.549999999999997 110.774 175.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.476 HD12 ' HB3' ' A' ' 22' ' ' HIS . 6.6 mp -114.78 140.93 48.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.816 0.341 . . . . 72.439999999999998 110.893 -178.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 26.4 mtt-85 -127.41 155.77 43.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.837 -0.62 . . . . 70.25 110.957 179.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.845 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 42.7 tt0 -74.92 117.4 16.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.98 -0.555 . . . . 64.530000000000001 110.378 -179.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 26' ' ' LEU . 10.0 mt -86.1 -45.34 11.48 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.069 -0.514 . . . . 73.219999999999999 111.566 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.1 tp -140.04 139.77 36.03 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.084 -0.507 . . . . 73.219999999999999 111.262 -165.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.8 mtp180 -115.49 94.94 4.92 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.331 -0.85 . . . . 73.239999999999995 108.712 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.423 ' O ' ' HB3' ' A' ' 68' ' ' ARG . 43.0 m -137.74 104.74 5.39 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.247 0.546 . . . . 73.25 112.403 -169.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -89.74 -1.05 57.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.246 0.546 . . . . 73.299999999999997 109.727 174.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -68.88 -33.98 74.68 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.142 -0.936 . . . . 75.209999999999994 111.682 -176.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 73.23 -50.85 0.7 Allowed 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.663 0.785 . . . . 75.219999999999999 112.096 -179.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 56.3 t -66.64 -49.15 77.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.689 0.28 . . . . 62.020000000000003 110.521 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 64.5 tp -56.93 -38.29 72.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.197 0.522 . . . . 75.099999999999994 110.287 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.404 ' O ' HD23 ' A' ' 35' ' ' LEU . 6.0 tt -63.69 -32.75 74.33 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.709 -0.678 . . . . 74.540000000000006 110.562 -179.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.7 m -61.83 -37.04 82.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.995 0.426 . . . . 61.310000000000002 110.888 -179.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -69.3 -42.99 74.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 73.230000000000004 110.649 179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 85.1 t -67.14 -42.49 88.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.008 -0.542 . . . . 74.420000000000002 110.612 178.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.96 -35.03 89.96 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.773 -0.649 . . . . 44.310000000000002 112.486 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.64 -32.89 74.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.708 0.289 . . . . 63.109999999999999 110.796 178.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.3 mt -69.31 -49.5 55.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.185 -0.462 . . . . 71.209999999999994 110.477 178.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.566 ' HA ' HD12 ' A' ' 47' ' ' ILE . 76.2 mt -62.75 -55.16 29.11 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.703 -0.68 . . . . 64.109999999999999 111.077 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.37 -25.07 67.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.393 -0.367 . . . . 64.209999999999994 111.214 -179.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.53 -30.65 75.11 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 121.062 -0.589 . . . . 74.219999999999999 112.431 179.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -109.76 8.16 24.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.963 0.411 . . . . 53.310000000000002 110.63 178.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.464 ' OD2' ' HA ' ' A' ' 10' ' ' HIS . 26.2 t0 56.52 43.24 26.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 122.021 0.915 . . . . 63.549999999999997 110.623 -175.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.566 HD12 ' HA ' ' A' ' 42' ' ' LEU . 68.0 mt -67.66 -27.46 38.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 114.949 -1.023 . . . . 71.329999999999998 109.816 174.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.56 -178.79 35.52 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.163 -0.926 . . . . 73.439999999999998 111.468 -177.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -165.81 125.31 1.69 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.018 0.437 . . . . 75.510000000000005 111.618 179.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.671 ' HB3' ' HB2' ' A' ' 71' ' ' LEU . 61.7 tp -105.88 100.14 9.7 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 107.988 -1.115 . . . . 73.329999999999998 107.988 166.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.434 ' HA ' ' O ' ' A' ' 69' ' ' ARG . 21.9 m -116.55 172.64 4.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 116.473 -0.331 . . . . 50.340000000000003 111.755 -172.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 52' ' ' LEU . 4.2 mm? 68.08 -169.73 0.19 Allowed 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.414 -0.812 . . . . 70.530000000000001 111.648 178.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -158.91 -38.65 0.06 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.349 -0.841 . . . . 73.200000000000003 109.052 -176.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 23.1 tm0? -147.04 135.6 21.95 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.075 -1.083 . . . . 53.240000000000002 108.075 172.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -103.07 122.86 45.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.11 0.481 . . . . 72.319999999999993 111.671 -173.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.8 ptt? -152.69 -171.71 4.02 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.8 -0.636 . . . . 75.219999999999999 109.358 177.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.9 m -63.24 138.32 58.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.871 0.367 . . . . 72.510000000000005 110.631 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.6 tt -78.15 128.75 38.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.148 0.499 . . . . 51.399999999999999 111.229 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 59' ' ' LEU . 1.2 tm? -141.94 125.14 16.4 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.506 -0.924 . . . . 65.140000000000001 108.506 177.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -127.63 178.97 5.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.875 0.369 . . . . 71.040000000000006 110.984 -176.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 138.73 -115.89 1.2 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.433 -0.667 . . . . 60.140000000000001 111.433 -177.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.3 m -118.69 82.0 1.78 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.94 0.4 . . . . 71.349999999999994 110.262 177.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.408 ' HG ' HG23 ' A' ' 65' ' ' VAL . 25.9 tp -175.78 97.44 0.07 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.885 -0.598 . . . . 75.200000000000003 109.844 -177.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -105.72 64.33 0.3 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.634 -0.793 . . . . 64.030000000000001 111.998 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.408 HG23 ' HG ' ' A' ' 63' ' ' LEU . 64.8 t -90.16 -32.18 5.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 120.878 0.371 . . . . 52.439999999999998 110.681 -178.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.406 HD12 ' N ' ' A' ' 66' ' ' ILE . 3.8 mp -98.89 107.9 46.06 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.124 -0.489 . . . . 64.310000000000002 110.333 -179.094 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -82.5 104.96 1.38 Allowed 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 122.3 2.0 . . . . 65.430000000000007 111.41 176.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.423 ' HB3' ' O ' ' A' ' 29' ' ' THR . 24.0 ttm180 -72.97 117.85 15.2 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.268 -0.642 . . . . 73.109999999999999 109.268 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.434 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 8.9 ptp85 -113.84 134.48 54.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.783 -0.644 . . . . 72.140000000000001 111.236 -172.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 24.4 t -101.71 127.43 55.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.896 -0.593 . . . . 72.400000000000006 110.526 174.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.845 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.9 mp -121.66 147.68 45.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.794 -0.185 . . . . 63.329999999999998 111.115 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.515 HG23 HD22 ' A' ' 77' ' ' LEU . 35.7 m -134.67 178.76 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 N-CA-C 109.441 -0.577 . . . . 72.530000000000001 109.441 173.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 23' ' ' LEU . 7.4 p80 -96.65 177.14 5.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.73 0.3 . . . . 63.310000000000002 111.635 -174.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.476 ' HB3' ' HD2' ' A' ' 19' ' ' PHE . 0.0 OUTLIER -67.24 169.43 8.73 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.142 -0.481 . . . . 61.109999999999999 111.855 -178.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.1 t70 66.77 -65.39 0.21 Allowed 'General case' 0 N--CA 1.471 0.587 0 O-C-N 124.03 0.831 . . . . 64.319999999999993 109.877 -174.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -54.32 -26.56 30.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.677 -1.147 . . . . 70.420000000000002 111.164 176.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.515 HD22 HG23 ' A' ' 72' ' ' VAL . 0.1 OUTLIER -50.03 -40.66 45.55 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.798 -0.637 . . . . 62.240000000000002 110.554 178.357 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.52 -41.46 69.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 54.109999999999999 110.872 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.23 -45.33 81.59 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.085 -0.579 . . . . 74.349999999999994 112.145 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.55 -44.34 93.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.653 0.263 . . . . 75.150000000000006 110.855 178.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 30.1 mtp180 -60.2 -48.71 80.58 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.448 -0.342 . . . . 75.340000000000003 110.717 177.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -59.34 -40.52 86.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.062 -0.517 . . . . 73.319999999999993 110.688 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 42.0 tp -61.79 -49.45 76.31 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.888 -0.596 . . . . 73.299999999999997 110.809 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.6 mp -68.28 -29.03 67.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.088 -0.505 . . . . 51.039999999999999 111.4 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 51.1 m -69.56 -45.27 69.1 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.764 0.316 . . . . 53.219999999999999 110.251 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -62.4 -36.93 83.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 74.129999999999995 110.832 177.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -75.26 -18.09 60.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.92 -0.582 . . . . 74.099999999999994 111.153 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 83.02 23.37 55.53 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.123 -0.56 . . . . 55.140000000000001 113.02 177.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.1 mt -107.01 -3.03 20.51 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 122.541 -0.388 . . . . 51.32 111.186 -179.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.781 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -75.56 86.23 2.65 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.352 -0.385 . . . . 61.240000000000002 111.152 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -147.16 -43.26 0.18 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.113 -0.494 . . . . 64.409999999999997 110.757 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -91.75 18.53 7.51 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.35 0.595 . . . . 60.299999999999997 110.69 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.781 HD13 ' HA ' ' A' ' 90' ' ' ALA . 9.7 mp -82.18 167.02 19.12 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.66 -0.7 . . . . 73.439999999999998 111.525 -177.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.597 ' HD2' ' OE1' ' A' ' 25' ' ' GLU . 28.0 ttt180 -103.06 94.49 5.57 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.471 -0.786 . . . . 71.319999999999993 109.4 177.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.466 ' O ' ' HB2' ' A' ' 96' ' ' ASP . 38.2 m -127.69 86.9 2.54 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 111.922 0.342 . . . . 63.009999999999998 111.922 -175.148 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . 0.466 ' HB2' ' O ' ' A' ' 95' ' ' SER . 30.1 t70 165.95 -40.5 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 O-C-N 124.328 1.018 . . . . 72.400000000000006 109.7 172.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.257 -0.878 . . . . 70.049999999999997 110.44 -178.735 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.9 mpp? . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 110.085 -0.339 . . . . 72.109999999999999 110.085 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -174.17 70.15 0.1 OUTLIER Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.998 -0.62 . . . . 71.019999999999996 111.839 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.1 m -106.94 26.18 10.42 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.976 0.417 . . . . 53.399999999999999 110.395 179.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 59.2 m -92.1 112.33 24.23 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.462 0.649 . . . . 55.439999999999998 111.525 -175.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.1 m170 -118.84 113.21 20.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.598 -0.728 . . . . 73.430000000000007 109.724 176.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.7 p80 -110.52 115.3 29.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.06 0.457 . . . . 74.019999999999996 109.903 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.4 p80 -151.76 134.74 15.74 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.973 -0.558 . . . . 73.349999999999994 110.429 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -150.97 123.66 8.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.833 -0.621 . . . . 73.0 110.086 177.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.76 88.54 1.41 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.355 -0.384 . . . . 71.230000000000004 110.551 -175.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 30.6 p-80 -164.25 134.11 4.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.277 -0.638 . . . . 72.219999999999999 109.277 178.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.2 m -157.61 110.74 2.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.639 0.257 . . . . 63.539999999999999 111.282 -178.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 p -166.23 143.72 5.32 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.159 -0.473 . . . . 42.43 110.441 174.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 150.04 108.4 0.44 Allowed Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.89 -0.672 . . . . 74.25 112.114 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 40.5 ttt180 -173.41 -60.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.985 0.421 . . . . 72.099999999999994 110.383 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -70.9 130.91 42.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.438 -0.801 . . . . 72.120000000000005 111.816 -172.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -126.31 149.12 49.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.423 -0.808 . . . . 73.129999999999995 109.312 175.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 75.8 mt -147.13 116.41 6.97 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.603 -0.271 . . . . 70.109999999999999 111.485 -175.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.407 ' HE2' HE21 ' A' ' 20' ' ' GLN . 21.5 p90 -157.75 137.3 12.04 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.274 -0.421 . . . . 74.340000000000003 110.193 173.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.775 ' HB2' ' HA ' ' A' ' 75' ' ' ASP . 96.6 m-85 -129.09 128.87 44.4 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.695 -0.684 . . . . 75.239999999999995 109.876 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.407 HE21 ' HE2' ' A' ' 18' ' ' TYR . 76.2 mt-30 -89.8 131.27 35.83 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.128 0.49 . . . . 51.32 111.069 -176.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 164.82 -164.49 37.0 Favored Glycine 0 N--CA 1.443 -0.867 0 N-CA-C 111.236 -0.746 . . . . 61.020000000000003 111.236 179.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.41 ' HB3' ' H ' ' A' ' 23' ' ' LEU . 6.3 t-80 -134.63 -100.79 0.24 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.84 -0.43 . . . . 71.549999999999997 109.84 177.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.553 HD21 HD13 ' A' ' 50' ' ' LEU . 5.7 mp -143.33 120.56 11.52 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.149 -0.315 . . . . 74.329999999999998 110.149 176.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 24' ' ' ARG . 50.6 mtm180 -111.34 170.32 8.2 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.996 -0.372 . . . . 74.439999999999998 109.996 173.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.669 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 36.6 tt0 -81.82 135.06 35.47 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.79 0.329 . . . . 72.049999999999997 111.29 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.837 HD21 HG22 ' A' ' 72' ' ' VAL . 4.4 mm? -97.23 -67.19 0.86 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.056 -0.52 . . . . 71.340000000000003 110.034 175.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.633 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 0.9 OUTLIER -142.82 157.9 44.16 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.24 -0.437 . . . . 72.430000000000007 110.559 177.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -138.01 101.73 4.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.828 -0.804 . . . . 63.509999999999998 108.828 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.0 t -113.59 170.25 8.38 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.242 -0.436 . . . . 74.310000000000002 110.525 -174.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.512 HD22 ' HG2' ' A' ' 67' ' ' PRO . 11.1 m120 -104.57 -3.78 23.42 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.066 0.46 . . . . 74.530000000000001 109.768 177.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -105.98 156.71 18.1 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.734 -0.666 . . . . 73.430000000000007 111.174 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.73 -15.13 11.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.199 -0.455 . . . . 73.109999999999999 110.999 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 82.5 t -71.75 -49.51 45.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.007 0.432 . . . . 74.040000000000006 110.744 -177.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 40.4 tp -59.86 -31.78 70.09 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.886 -0.597 . . . . 72.109999999999999 110.684 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 76.3 mt -67.58 -22.98 65.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.088 -0.506 . . . . 73.200000000000003 111.54 -178.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.6 m -67.97 -36.9 80.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.007 0.432 . . . . 73.129999999999995 110.238 176.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -72.18 -45.35 60.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.089 0.471 . . . . 74.109999999999999 110.317 177.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 96.7 t -63.81 -42.77 96.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.76 -0.654 . . . . 61.549999999999997 110.972 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.35 -37.42 94.03 Favored Glycine 0 N--CA 1.449 -0.471 0 CA-C-N 115.816 -0.629 . . . . 62.229999999999997 112.239 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.42 -31.3 72.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.758 0.314 . . . . 75.25 111.006 178.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 91.0 mt -70.42 -51.02 32.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.959 0.409 . . . . 73.129999999999995 110.159 177.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.672 ' HA ' HD12 ' A' ' 47' ' ' ILE . 48.3 mt -58.67 -52.87 63.83 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.602 -0.726 . . . . 72.319999999999993 110.969 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -67.75 -34.35 76.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.601 -0.727 . . . . 54.130000000000003 111.168 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.62 -15.2 61.51 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 116.12 -0.491 . . . . 63.25 112.443 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -100.76 -65.58 0.96 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.563 0.221 . . . . 64.329999999999998 110.609 176.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.0 t70 164.37 -19.78 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.402 -0.817 . . . . 73.329999999999998 109.09 -173.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.672 HD12 ' HA ' ' A' ' 42' ' ' LEU . 23.9 mt -51.04 106.41 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.428 0 CA-C-N 114.179 -1.373 . . . . 74.219999999999999 112.869 -166.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.59 114.16 6.44 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.414 -0.812 . . . . 40.109999999999999 111.274 173.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -127.34 130.45 49.47 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.931 0.396 . . . . 75.319999999999993 110.647 -173.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.553 HD13 HD21 ' A' ' 23' ' ' LEU . 8.7 mp -106.66 112.16 25.02 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.858 -0.61 . . . . 75.319999999999993 110.05 179.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 m -94.97 104.69 16.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.86 -0.609 . . . . 64.450000000000003 110.512 179.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.2 tt -102.18 124.86 48.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.847 -0.615 . . . . 63.219999999999999 110.563 -175.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.67 ' HB3' ' HE ' ' A' ' 68' ' ' ARG . 3.6 p30 -129.36 152.34 49.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.927 -0.579 . . . . 72.340000000000003 109.782 173.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.626 ' HB2' ' HB ' ' A' ' 66' ' ' ILE . 60.4 mt-30 -131.83 28.51 4.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.64 0.257 . . . . 72.299999999999997 111.342 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -75.15 102.36 4.91 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.907 -0.775 . . . . 73.319999999999993 108.907 174.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 62.2 mtm -76.34 -74.59 0.22 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.733 -0.667 . . . . 75.239999999999995 111.943 -170.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.3 m -99.38 128.31 45.49 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.249 -0.432 . . . . 70.0 110.398 -175.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 8.7 tt -117.75 101.06 11.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-O 121.711 0.767 . . . . 71.019999999999996 110.834 -179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.9 tp -92.63 -31.98 14.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.526 -0.761 . . . . 71.439999999999998 109.291 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -158.36 -44.89 0.06 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.796 -1.093 . . . . 74.040000000000006 108.303 177.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.56 -53.8 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 115.525 -0.761 . . . . 62.43 111.733 177.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 67.7 m 70.77 167.14 0.3 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 123.288 0.635 . . . . 71.420000000000002 112.084 178.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -90.89 92.3 8.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.931 -0.577 . . . . 44.219999999999999 110.132 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.5 98.76 1.05 Allowed Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.684 -0.769 . . . . 61.420000000000002 111.754 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 31.9 t -57.19 -45.64 84.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.457 0.646 . . . . 60.32 109.846 177.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.626 ' HB ' ' HB2' ' A' ' 54' ' ' GLN . 4.2 mp -113.56 91.66 21.3 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.273 -0.876 . . . . 74.430000000000007 108.67 171.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.512 ' HG2' HD22 ' A' ' 30' ' ' ASN . 21.9 Cg_exo -65.89 -69.39 0.03 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.797 2.332 . . . . 71.319999999999993 111.76 -178.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.67 ' HE ' ' HB3' ' A' ' 53' ' ' ASP . 0.7 OUTLIER -158.08 116.63 3.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.11 -0.495 . . . . 75.340000000000003 110.367 175.778 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -113.91 132.41 55.94 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.739 -0.664 . . . . 75.109999999999999 109.33 177.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.402 ' C ' HD12 ' A' ' 71' ' ' LEU . 52.2 t -109.74 118.49 56.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.405 -0.361 . . . . 61.219999999999999 110.448 -177.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.669 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 6.5 mp -125.74 144.37 50.65 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.996 -0.547 . . . . 62.200000000000003 109.914 177.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.837 HG22 HD21 ' A' ' 26' ' ' LEU . 33.2 m -127.68 165.66 26.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.931 -0.396 . . . . 75.340000000000003 109.931 177.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.488 ' ND1' ' HB3' ' A' ' 75' ' ' ASP . 0.4 OUTLIER -69.59 133.82 48.06 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.582 -0.281 . . . . 62.539999999999999 110.504 178.307 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.481 ' HA ' ' HB2' ' A' ' 77' ' ' LEU . 43.7 mm-40 -51.5 -28.46 13.55 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.137 0.575 . . . . 72.549999999999997 111.945 -177.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.775 ' HA ' ' HB2' ' A' ' 19' ' ' PHE . 34.9 t70 -58.4 -17.7 22.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.453 -0.794 . . . . 71.0 112.124 -179.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -131.59 13.24 4.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.157 0.503 . . . . 71.510000000000005 109.928 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -57.3 -51.21 70.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.983 -0.553 . . . . 73.099999999999994 110.883 -174.441 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.16 -36.2 82.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.904 -0.589 . . . . 54.32 111.459 -177.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.61 -47.39 21.32 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.627 -0.797 . . . . 71.230000000000004 111.956 -179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.05 -44.67 87.57 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.691 0.256 . . . . 71.400000000000006 111.691 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -59.68 -49.13 78.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.695 -0.229 . . . . 63.229999999999997 111.575 -177.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 20.5 ttt180 -65.56 -35.28 80.39 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.424 -0.51 . . . . 72.400000000000006 110.712 -178.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.2 tp -61.97 -43.07 99.61 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.932 0.396 . . . . 75.329999999999998 110.211 178.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.73 -28.54 66.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.0 -0.546 . . . . 74.310000000000002 111.236 178.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.41 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 19.2 m -77.33 -48.81 16.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.164 0.507 . . . . 64.010000000000005 110.781 176.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -68.04 -44.39 76.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.167 -0.924 . . . . 65.019999999999996 112.122 -171.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -123.06 28.3 7.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.89 0.376 . . . . 44.43 111.747 -175.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -139.96 -80.98 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.103 -1.046 . . . . 73.540000000000006 112.252 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.54 HD13 ' OE1' ' A' ' 92' ' ' GLU . 0.6 OUTLIER -179.12 -57.12 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 122.321 0.248 . . . . 63.009999999999998 111.187 -173.434 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.988 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . 60.12 20.99 10.24 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.025 0.53 . . . . 74.439999999999998 112.055 -177.048 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . 0.476 ' H ' HD12 ' A' ' 89' ' ' LEU . 57.1 t-80 -100.67 -29.27 12.39 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.089 0.471 . . . . 73.129999999999995 110.651 -176.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.54 ' OE1' HD13 ' A' ' 89' ' ' LEU . 5.4 mp0 -94.75 6.96 47.42 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.823 -0.626 . . . . 75.450000000000003 110.701 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.988 HD13 ' HA ' ' A' ' 90' ' ' ALA . 11.1 mp -73.13 150.61 42.08 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.205 -0.452 . . . . 74.150000000000006 110.701 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 94' ' ' ARG . 22.3 ttt85 -121.93 -64.15 1.24 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.533 -0.758 . . . . 72.340000000000003 109.755 -173.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.546 ' HA ' ' O ' ' A' ' 25' ' ' GLU . 16.3 m 69.67 165.39 0.27 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.454 -0.793 . . . . 74.319999999999993 111.655 177.509 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . 0.418 ' OD1' ' HB3' ' A' ' 24' ' ' ARG . 11.0 p-10 -111.24 -9.93 14.29 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.05 -0.523 . . . . 72.25 110.704 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 C--O 1.246 0.892 0 CA-C-O 118.582 -0.723 . . . . 35.530000000000001 110.395 173.752 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 mmt . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.748 0.308 . . . . 52.439999999999998 110.201 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 106.98 56.9 0.61 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.929 -0.653 . . . . 63.329999999999998 112.299 177.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.7 m -116.82 78.54 1.22 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.037 0.446 . . . . 71.230000000000004 110.697 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 67.2 m -127.03 144.52 51.0 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.08 -0.509 . . . . 73.010000000000005 110.435 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -134.71 101.58 4.98 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.182 -0.673 . . . . 62.149999999999999 109.182 178.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.7 t60 -135.58 125.94 26.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.856 -0.611 . . . . 75.439999999999998 111.165 -172.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -150.3 132.98 15.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.157 -0.474 . . . . 70.129999999999995 109.903 173.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.5 t60 -132.8 108.95 9.31 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.724 -0.473 . . . . 72.420000000000002 109.724 179.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -152.04 98.5 2.44 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.302 -0.408 . . . . 74.439999999999998 111.107 -175.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -157.14 113.0 2.9 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.354 0.597 . . . . 55.530000000000001 110.344 173.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.7 m -134.5 137.23 43.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.6 -0.727 . . . . 75.129999999999995 109.661 178.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.3 m -139.55 167.04 22.99 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.038 -0.528 . . . . 73.209999999999994 110.122 -176.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 141.51 85.52 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.131 -1.033 . . . . 75.109999999999999 113.728 174.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 17.1 ptt180 -149.82 100.88 3.0 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.233 0.539 . . . . 73.439999999999998 110.692 172.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -166.05 144.93 5.92 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.019 -0.537 . . . . 73.140000000000001 110.275 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -179.58 19.11 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 O-C-N 123.536 0.523 . . . . 64.040000000000006 110.763 177.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 93.6 mt -101.64 156.29 17.58 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.08 0.4 . . . . 74.219999999999999 112.08 -171.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.41 ' O ' ' HB2' ' A' ' 19' ' ' PHE . 0.2 OUTLIER 72.36 -177.57 0.19 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.074 -0.966 . . . . 74.040000000000006 112.564 171.836 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.41 ' HB2' ' O ' ' A' ' 18' ' ' TYR . 87.8 m-85 78.88 63.0 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.204 1.002 . . . . 73.099999999999994 111.912 175.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -141.18 147.1 37.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.823 -0.626 . . . . 71.340000000000003 109.91 172.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 166.76 -138.84 5.41 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.472 -0.87 . . . . 65.150000000000006 112.758 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.7 m-70 -123.05 75.41 1.29 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.66 -0.496 . . . . 72.140000000000001 109.66 178.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 93.2 mt 63.17 162.88 0.1 Allowed 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.806 0.691 . . . . 72.230000000000004 110.509 -171.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.78 HH12 ' HB3' ' A' ' 97' ' ' ASP . 27.8 mmm180 -132.74 127.52 34.88 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 121.992 -0.442 . . . . 62.009999999999998 110.889 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.546 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 42.5 tt0 -70.56 120.93 16.92 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.557 -0.747 . . . . 74.340000000000003 109.05 174.464 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.46 HD12 HD22 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -79.6 -51.96 8.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.889 0.376 . . . . 74.530000000000001 110.098 -174.895 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.46 HD22 HD12 ' A' ' 26' ' ' LEU . 2.7 pt? -157.4 154.53 29.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.177 -0.465 . . . . 74.430000000000007 110.701 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.569 ' HG3' ' HB3' ' A' ' 69' ' ' ARG . 22.1 ttm180 -131.7 111.41 11.65 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.702 -0.851 . . . . 74.239999999999995 108.702 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.7 t -126.92 164.7 20.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.138 0.494 . . . . 72.340000000000003 111.523 -173.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.444 ' ND2' ' HB3' ' A' ' 67' ' ' PRO . 8.1 m120 -107.88 -6.89 16.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.655 -0.702 . . . . 74.439999999999998 109.955 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -95.45 134.47 38.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.763 -0.653 . . . . 74.129999999999995 111.332 -175.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -78.35 -33.26 49.19 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.813 -0.63 . . . . 73.400000000000006 111.587 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.1 t -59.96 -47.44 91.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-O 120.93 0.395 . . . . 63.049999999999997 110.69 -177.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 53.3 tp -62.22 -40.24 95.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.672 -0.695 . . . . 75.340000000000003 110.572 178.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.63 -43.41 98.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.992 -0.549 . . . . 63.520000000000003 111.081 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 16.6 m -59.5 -40.78 88.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.791 0.329 . . . . 55.420000000000002 111.016 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.503 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -71.97 -54.64 9.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.117 -0.492 . . . . 42.210000000000001 111.181 -177.528 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.403 HG13 HD21 ' A' ' 84' ' ' LEU . 86.9 t -61.26 -39.53 82.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-O 121.194 0.521 . . . . 73.450000000000003 110.315 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -61.82 -49.0 80.33 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.351 -0.841 . . . . 71.040000000000006 112.262 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.28 -33.02 74.87 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.639 0.257 . . . . 71.540000000000006 111.305 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 95.0 mt -65.68 -51.78 56.74 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.323 -0.399 . . . . 63.420000000000002 110.678 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 78.6 mt -74.39 -27.3 60.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.113 -0.494 . . . . 71.040000000000006 110.671 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -74.91 -55.63 5.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.13 -0.486 . . . . 61.520000000000003 110.631 179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.66 -36.2 92.06 Favored Glycine 0 C--N 1.332 0.31 0 CA-C-N 115.698 -0.683 . . . . 70.310000000000002 112.84 -175.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.487 ' HB3' HG12 ' A' ' 47' ' ' ILE . . . -82.81 -1.69 52.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.763 0.316 . . . . 72.219999999999999 110.747 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.2 t70 60.72 26.78 16.55 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.462 0.648 . . . . 74.319999999999993 111.067 178.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.487 HG12 ' HB3' ' A' ' 45' ' ' ALA . 47.2 mm -63.64 -39.32 84.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.532 0.682 . . . . 52.219999999999999 110.106 -179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 110.64 125.79 4.9 Favored Glycine 0 N--CA 1.443 -0.881 0 CA-C-N 115.208 -0.905 . . . . 61.539999999999999 112.276 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -139.0 141.81 38.32 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.71 0.291 . . . . 73.010000000000005 110.683 -178.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -109.6 90.67 3.37 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.313 -0.995 . . . . 74.319999999999993 108.313 171.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.9 m -130.85 -174.63 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.974 -0.557 . . . . 72.409999999999997 111.499 -175.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 36.0 tp -160.49 156.62 26.21 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.398 -0.964 . . . . 74.530000000000001 108.398 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -70.14 145.39 51.56 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.429 -0.582 . . . . 65.420000000000002 109.429 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.448 ' O ' ' HB ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -122.27 18.07 10.67 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.915 0.709 . . . . 74.420000000000002 112.915 -168.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -146.72 138.39 24.49 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.268 -0.573 . . . . 60.210000000000001 110.647 177.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.447 ' HB3' ' HB3' ' A' ' 59' ' ' LEU . 3.5 mpp? -79.4 143.65 34.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.286 -0.416 . . . . 72.25 110.443 -178.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.6 m -83.96 63.94 7.86 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.726 -0.472 . . . . 63.240000000000002 109.726 177.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.3 mm 69.23 90.61 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 CA-C-N 115.298 -0.865 . . . . 72.019999999999996 110.373 -174.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.574 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 64.6 tp -160.37 104.75 1.45 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.605 -0.725 . . . . 70.409999999999997 109.681 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 59' ' ' LEU . 11.7 pt-20 55.57 -54.6 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.736 1.614 . . . . 64.140000000000001 113.326 -175.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -106.79 114.08 4.26 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.979 -0.849 . . . . 42.100000000000001 110.979 175.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.2 m -63.24 -44.69 94.49 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.993 0.425 . . . . 53.109999999999999 110.845 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 44.0 tp -123.73 88.27 2.88 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.216 -0.447 . . . . 74.540000000000006 109.847 175.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.65 147.83 18.97 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 121.003 -0.618 . . . . 64.209999999999994 111.995 -179.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.1 t -106.85 91.77 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.107 0.479 . . . . 73.319999999999993 110.253 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.448 ' HB ' ' O ' ' A' ' 54' ' ' GLN . 50.1 mm -101.22 108.74 56.25 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.972 -0.558 . . . . 75.329999999999998 109.708 175.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . 0.444 ' HB3' ' ND2' ' A' ' 30' ' ' ASN . 37.3 Cg_endo -67.25 111.6 2.31 Favored 'Trans proline' 0 C--O 1.235 0.345 0 C-N-CA 122.633 2.222 . . . . 61.229999999999997 111.708 179.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.486 ' HA ' ' HD2' ' A' ' 68' ' ' ARG . 10.1 tpt180 -100.87 140.81 34.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.38 0.61 . . . . 72.310000000000002 110.985 -177.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.569 ' HB3' ' HG3' ' A' ' 28' ' ' ARG . 28.3 ptt180 -113.61 146.69 39.35 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.135 -0.939 . . . . 74.109999999999999 110.357 178.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 64.6 t -110.04 116.75 53.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 116.415 -0.357 . . . . 61.409999999999997 110.444 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.7 mp -102.79 137.62 40.76 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.548 -0.538 . . . . 65.209999999999994 109.548 174.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 25.3 m -114.99 176.9 2.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.227 -0.442 . . . . 65.340000000000003 110.504 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -69.9 129.33 39.22 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.686 -0.688 . . . . 75.319999999999993 109.519 176.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.401 ' H ' ' HG2' ' A' ' 74' ' ' GLU . 5.9 pt-20 -57.75 -35.93 71.39 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.006 0.431 . . . . 64.049999999999997 111.125 -179.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -73.6 -16.91 61.23 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.731 -0.668 . . . . 63.409999999999997 110.142 -176.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -111.33 23.62 13.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.964 -0.562 . . . . 71.540000000000006 110.093 -175.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.529 HD21 ' HB2' ' A' ' 24' ' ' ARG . 0.1 OUTLIER -51.32 -50.86 58.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.753 -0.658 . . . . 71.099999999999994 110.711 -178.436 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -69.13 -28.37 66.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.019 -0.537 . . . . 64.319999999999993 111.622 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.42 -57.23 5.18 Favored Glycine 0 C--O 1.236 0.23 0 C-N-CA 120.718 -0.754 . . . . 71.409999999999997 112.611 -175.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.38 -42.87 96.75 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.889 0.329 . . . . 73.120000000000005 111.889 -177.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 77' ' ' LEU . 14.6 ptm180 -67.22 -33.23 74.91 Favored 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 120.943 -0.303 . . . . 72.329999999999998 110.91 -178.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -63.0 -42.28 99.81 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.016 0.436 . . . . 73.530000000000001 109.852 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 34.8 tp -58.49 -46.99 85.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.6 -0.727 . . . . 70.239999999999995 110.451 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.403 HD21 HG13 ' A' ' 38' ' ' VAL . 84.0 mt -68.49 -32.46 72.47 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.768 -0.651 . . . . 64.310000000000002 111.226 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 55.6 m -70.37 -36.82 74.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.975 0.417 . . . . 61.039999999999999 110.551 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -69.04 -40.58 78.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.019 -0.537 . . . . 64.019999999999996 110.445 178.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.48 -30.16 69.78 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 115.868 -0.605 . . . . 73.200000000000003 111.044 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 100.29 -13.79 59.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.121 -0.562 . . . . 73.319999999999993 112.673 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 61.6 mt -78.91 1.9 21.99 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.178 0.436 . . . . 63.530000000000001 112.178 -176.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -75.73 91.32 2.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.056 0.455 . . . . 62.119999999999997 109.827 175.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -140.46 -40.32 0.42 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.904 -0.589 . . . . 75.129999999999995 110.001 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.6 mp0 -87.39 29.63 0.85 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.627 -0.715 . . . . 71.340000000000003 111.492 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.552 HD12 ' H ' ' A' ' 93' ' ' LEU . 4.1 mp -62.81 145.1 55.76 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 120.705 0.288 . . . . 70.140000000000001 110.482 -178.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.431 ' HD2' ' HA ' ' A' ' 94' ' ' ARG . 2.3 tpt180 -129.43 173.19 10.78 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.728 -0.471 . . . . 71.450000000000003 109.728 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 58.2 m -149.01 121.43 8.47 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.861 0.362 . . . . 62.100000000000001 110.198 177.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -103.16 90.2 3.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.178 0.513 . . . . 74.450000000000003 111.316 -176.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.78 ' HB3' HH12 ' A' ' 24' ' ' ARG . 5.9 p-10 . . . . . 0 C--O 1.248 0.991 0 CA-C-N 115.537 -0.756 . . . . 75.430000000000007 109.962 177.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ttt . . . . . 0 N--CA 1.484 1.255 0 CA-C-O 120.529 0.204 . . . . 72.25 110.986 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.18 127.59 0.92 Allowed Glycine 0 N--CA 1.443 -0.836 0 C-N-CA 120.222 -0.99 . . . . 54.119999999999997 113.065 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.2 p -153.4 82.24 1.18 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.224 -0.658 . . . . 63.409999999999997 109.224 173.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 24.3 p -89.51 117.76 28.65 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.78 -0.645 . . . . 74.140000000000001 111.471 -172.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -139.37 111.44 7.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.087 -0.708 . . . . 73.430000000000007 109.087 176.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.6 p-80 -153.38 107.26 3.04 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.081 0.467 . . . . 70.140000000000001 111.18 -177.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -150.7 102.34 3.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.893 -0.594 . . . . 73.030000000000001 111.138 175.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -140.79 118.86 11.92 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.351 -0.611 . . . . 74.209999999999994 109.351 171.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -146.13 95.22 2.59 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.224 -0.444 . . . . 72.400000000000006 110.639 -177.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -131.76 53.23 2.01 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.814 -0.81 . . . . 64.010000000000005 108.814 174.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -72.46 90.87 1.34 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.324 -0.853 . . . . 72.200000000000003 110.813 -177.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.3 p -121.4 -178.13 3.71 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.84 -0.618 . . . . 75.209999999999994 110.32 -179.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 106.76 90.17 2.14 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.779 -0.724 . . . . 64.019999999999996 111.691 -179.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 14' ' ' ARG . 10.4 ttp180 -76.64 -65.17 0.97 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.641 -0.503 . . . . 62.329999999999998 109.641 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -172.11 111.27 0.27 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.302 -0.863 . . . . 55.240000000000002 110.093 -176.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -164.78 121.1 1.49 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.317 -0.994 . . . . 61.439999999999998 108.317 -178.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 93.1 mt -96.79 99.26 10.85 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.414 0.626 . . . . 65.310000000000002 111.144 -175.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.2 p90 -122.21 95.26 4.58 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.454 -0.793 . . . . 73.409999999999997 110.377 175.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.408 ' HB2' ' H ' ' A' ' 20' ' ' GLN . 57.3 m-85 -90.73 -88.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.158 -0.682 . . . . 72.450000000000003 109.158 178.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.408 ' H ' ' HB2' ' A' ' 19' ' ' PHE . 65.1 mt-30 66.21 -66.7 0.16 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 124.011 0.819 . . . . 71.010000000000005 112.552 172.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 152.64 153.19 6.21 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.801 -0.92 . . . . 42.109999999999999 110.801 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -108.65 -31.72 7.64 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.557 -0.534 . . . . 73.420000000000002 109.557 178.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.767 HD22 ' HB2' ' A' ' 50' ' ' LEU . 7.4 mp 66.86 154.63 0.09 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.23 -0.895 . . . . 64.530000000000001 111.518 178.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.634 ' HB2' HD11 ' A' ' 77' ' ' LEU . 13.1 mmt180 -115.2 133.18 56.27 Favored 'General case' 0 C--N 1.321 -0.668 0 O-C-N 121.831 -0.543 . . . . 65.530000000000001 110.545 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.589 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.5 tt0 -66.93 126.96 30.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.22 -0.9 . . . . 75.329999999999998 110.409 -176.247 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.477 ' CD1' ' HG2' ' A' ' 81' ' ' ARG . 20.2 tp -106.61 -58.21 1.96 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.41 -0.814 . . . . 72.040000000000006 110.772 -175.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.842 ' HB3' HD23 ' A' ' 93' ' ' LEU . 4.6 pp -147.71 167.99 23.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.388 -0.369 . . . . 63.549999999999997 110.1 178.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.538 ' HD2' ' O ' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -148.02 143.91 27.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.88 0.372 . . . . 75.129999999999995 111.527 179.213 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.8 t -174.02 163.17 3.96 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.605 -0.725 . . . . 62.310000000000002 109.995 178.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -100.06 -4.23 30.3 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.958 0.409 . . . . 54.25 109.924 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -75.8 117.68 17.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.766 -0.652 . . . . 75.439999999999998 110.344 -177.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.514 ' HB2' HH22 ' A' ' 68' ' ' ARG . . . -74.57 -38.44 62.68 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.323 -0.399 . . . . 64.109999999999999 111.263 -176.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 45.2 t -63.44 -46.44 95.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.088 0.471 . . . . 63.530000000000001 110.459 -177.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 33.1 tp -61.39 -39.95 92.56 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.696 -0.684 . . . . 70.450000000000003 110.584 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.556 ' HA ' HG12 ' A' ' 38' ' ' VAL . 80.9 mt -72.11 -24.65 61.52 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.957 -0.565 . . . . 75.239999999999995 111.514 -178.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 49.9 m -75.05 -27.59 60.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.945 0.403 . . . . 53.32 110.306 176.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.62 -53.74 7.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 71.409999999999997 110.582 177.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.73 HG21 HD21 ' A' ' 27' ' ' LEU . 7.2 p -64.92 -35.37 75.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 120.915 0.388 . . . . 65.439999999999998 111.153 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.37 -38.97 95.53 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.004 -0.617 . . . . 64.439999999999998 112.307 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.96 -29.98 70.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.878 0.371 . . . . 65.200000000000003 111.135 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 88.0 mt -69.39 -49.18 57.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.127 -0.488 . . . . 63.210000000000001 109.968 178.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.9 mt -66.15 -35.0 79.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.672 -0.695 . . . . 74.109999999999999 110.589 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.12 -52.43 48.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.769 -0.651 . . . . 73.109999999999999 110.737 176.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.53 -26.88 73.57 Favored Glycine 0 N--CA 1.449 -0.436 0 CA-C-N 115.689 -0.687 . . . . 71.230000000000004 113.966 -173.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.02 9.11 37.13 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.835 0.318 . . . . 74.430000000000007 111.826 -177.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.6 t70 61.17 29.13 18.63 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.753 0.787 . . . . 73.510000000000005 110.732 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.3 mt -84.26 -47.62 17.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.541 0.686 . . . . 65.209999999999994 110.185 -179.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.21 172.74 38.67 Favored Glycine 0 N--CA 1.445 -0.712 0 CA-C-N 115.083 -0.962 . . . . 73.439999999999998 111.601 -176.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -169.24 142.13 2.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.946 0.403 . . . . 73.239999999999995 111.406 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.767 ' HB2' HD22 ' A' ' 23' ' ' LEU . 1.9 tm? -97.19 102.25 13.98 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.355 -0.98 . . . . 74.230000000000004 108.355 172.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.7 m -131.48 161.66 40.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.977 -0.556 . . . . 64.129999999999995 110.468 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 95.9 mt 68.88 170.69 0.29 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.738 -0.665 . . . . 74.230000000000004 111.516 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -170.59 -45.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.785 -0.643 . . . . 74.230000000000004 110.521 -177.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -57.74 -54.98 40.73 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.321 -0.399 . . . . 71.299999999999997 111.375 -178.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 72.02 -40.72 0.48 Allowed 'General case' 0 N--CA 1.473 0.704 0 O-C-N 123.877 0.736 . . . . 74.519999999999996 111.91 177.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 78.9 mtp -73.73 168.63 18.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.833 0.349 . . . . 75.030000000000001 110.746 178.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.2 p -75.32 164.18 26.7 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.034 -0.53 . . . . 64.439999999999998 110.224 176.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 5.8 tp -73.5 103.89 2.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.507 0.67 . . . . 74.530000000000001 110.426 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -107.01 127.27 53.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.344 -0.843 . . . . 71.510000000000005 109.059 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -60.83 124.2 19.76 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.445 0.641 . . . . 73.239999999999995 110.767 -179.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 128.15 -32.55 3.39 Favored Glycine 0 N--CA 1.443 -0.868 0 N-CA-C 110.497 -1.041 . . . . 71.019999999999996 110.497 -173.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.3 p -105.04 104.37 14.1 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.173 -0.677 . . . . 75.230000000000004 109.173 171.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.8 mp -86.1 85.11 7.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.432 0.635 . . . . 75.099999999999994 109.975 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -124.61 109.75 1.29 Allowed Glycine 0 N--CA 1.439 -1.116 0 C-N-CA 120.694 -0.765 . . . . 72.129999999999995 112.728 -177.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 38.8 t -86.25 -16.08 9.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.42 -0.956 . . . . 53.340000000000003 108.42 169.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.73 HG22 ' HG3' ' A' ' 68' ' ' ARG . 5.0 mp 57.41 85.53 0.19 Allowed Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 114.029 -1.441 . . . . 73.540000000000006 111.131 -178.067 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.01 90.9 0.44 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.302 2.002 . . . . 73.340000000000003 110.237 172.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.73 ' HG3' HG22 ' A' ' 66' ' ' ILE . 64.5 mtm180 -75.83 126.46 31.04 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.671 0.748 . . . . 73.140000000000001 112.337 -170.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -113.13 131.43 55.84 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.584 -1.189 . . . . 72.329999999999998 108.023 173.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 55.5 t -101.45 111.6 31.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-O 120.769 0.319 . . . . 75.439999999999998 110.772 -172.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.658 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 7.7 mp -102.73 142.73 33.39 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.639 -0.71 . . . . 74.0 109.104 174.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 20.6 m -119.96 174.26 5.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.204 0.526 . . . . 73.329999999999998 111.484 -174.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -57.69 121.89 11.48 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.812 -1.086 . . . . 64.049999999999997 110.949 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.565 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 36.9 mt-10 -62.87 154.0 31.47 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.879 -0.6 . . . . 71.219999999999999 109.459 177.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.565 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 8.6 t70 78.92 -16.79 0.64 Allowed 'General case' 0 N--CA 1.473 0.689 0 O-C-N 123.921 0.763 . . . . 71.349999999999994 111.213 -173.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -104.36 16.87 25.25 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.159 0.504 . . . . 73.219999999999999 110.246 -177.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.634 HD11 ' HB2' ' A' ' 24' ' ' ARG . 4.2 mm? -60.94 -49.09 78.88 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.671 -0.695 . . . . 61.340000000000003 111.295 -177.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.42 -22.46 66.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.912 0.387 . . . . 44.409999999999997 111.192 -178.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -84.61 -56.08 2.57 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.642 -0.79 . . . . 64.340000000000003 112.541 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.412 ' O ' HD13 ' A' ' 84' ' ' LEU . . . -61.17 -44.42 97.34 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.749 0.277 . . . . 65.150000000000006 111.749 -176.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.477 ' HG2' ' CD1' ' A' ' 26' ' ' LEU . 18.3 mtp180 -63.13 -36.96 85.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.937 0.399 . . . . 62.130000000000003 110.243 -178.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -68.34 -44.07 76.1 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.993 -0.548 . . . . 73.420000000000002 110.582 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.5 tp -56.28 -49.87 73.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 74.25 111.019 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.412 HD13 ' O ' ' A' ' 80' ' ' ALA . 9.1 mp -67.67 -28.23 67.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 75.340000000000003 111.416 -178.395 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.59 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.3 m -81.08 -40.02 24.79 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.47 -0.332 . . . . 74.519999999999996 111.211 -178.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -74.22 -42.28 60.0 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.27 -0.423 . . . . 63.420000000000002 111.217 -177.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -154.8 83.82 1.09 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.12 0.486 . . . . 62.109999999999999 110.361 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -170.33 -96.1 0.1 Allowed Glycine 0 N--CA 1.441 -1.01 0 C-N-CA 120.323 -0.942 . . . . 44.299999999999997 112.429 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.623 HD11 ' HB ' ' A' ' 38' ' ' VAL . 1.2 pp -175.0 48.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.197 0.522 . . . . 71.150000000000006 111.182 -172.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.59 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . -68.44 93.79 0.51 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.173 -0.467 . . . . 54.409999999999997 111.587 -177.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 71.1 t60 -151.14 -47.91 0.12 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.061 -0.518 . . . . 74.530000000000001 110.187 176.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 29.3 mp0 -76.73 -0.3 23.19 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.64 -0.709 . . . . 75.340000000000003 110.869 -178.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.842 HD23 ' HB3' ' A' ' 27' ' ' LEU . 90.5 mt -66.91 140.47 57.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.004 -0.544 . . . . 73.299999999999997 110.671 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.497 ' HG2' ' O ' ' A' ' 95' ' ' SER . 45.3 ttt180 -104.54 139.91 38.74 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.85 -0.34 . . . . 74.310000000000002 110.193 175.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.497 ' O ' ' HG2' ' A' ' 94' ' ' ARG . 30.2 m -72.02 162.56 29.29 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.623 -0.51 . . . . 62.310000000000002 109.623 173.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -80.16 52.65 1.59 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.18 0.515 . . . . 63.140000000000001 110.584 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 27.8 t70 . . . . . 0 C--O 1.243 0.737 0 CA-C-N 115.734 -0.666 . . . . 53.310000000000002 109.618 -178.371 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 109.775 -0.454 . . . . 54.210000000000001 109.775 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 174.82 -62.2 0.11 Allowed Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.591 -0.814 . . . . 55.439999999999998 112.216 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.4 m -105.38 101.13 10.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.863 0.363 . . . . 61.329999999999998 110.538 178.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.2 p -121.69 107.63 12.58 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.041 -0.527 . . . . 64.340000000000003 110.4 177.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -113.58 127.07 55.93 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.548 0.689 . . . . 73.219999999999999 111.505 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -157.04 93.75 1.36 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.889 -1.051 . . . . 72.230000000000004 108.699 175.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 p80 -148.8 154.68 39.88 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.367 -0.833 . . . . 60.409999999999997 110.33 -173.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.1 p-80 -156.39 143.12 18.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.826 0.346 . . . . 64.409999999999997 110.739 -177.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 55.7 t-80 -139.82 91.19 2.45 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.944 -0.571 . . . . 71.400000000000006 109.487 177.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -142.0 109.05 5.47 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.047 0.451 . . . . 74.030000000000001 110.563 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.7 t -82.13 -175.78 5.82 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.697 -0.683 . . . . 70.319999999999993 109.376 174.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.8 m -81.15 78.54 7.94 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.055 0.455 . . . . 74.219999999999999 110.391 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -118.46 134.13 10.74 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.881 -0.675 . . . . 71.219999999999999 111.802 179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 14' ' ' ARG . 30.6 ttt180 -164.41 125.54 2.17 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.829 0.347 . . . . 73.420000000000002 110.287 -179.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -142.48 73.59 1.41 Allowed 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.411 -0.589 . . . . 63.539999999999999 109.411 176.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.562 ' HB3' ' HA ' ' A' ' 75' ' ' ASP . 8.9 p30 -154.42 104.66 2.59 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.858 0.837 . . . . 73.099999999999994 110.717 176.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 90.8 mt -94.32 -5.43 46.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.396 -0.82 . . . . 65.420000000000002 109.171 171.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -116.38 108.53 16.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.906 -1.043 . . . . 70.540000000000006 109.818 178.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -90.21 128.66 36.43 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.048 -0.524 . . . . 72.200000000000003 109.873 177.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.534 ' HG2' ' HG2' ' A' ' 24' ' ' ARG . 21.0 tp60 -96.55 -48.61 5.47 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.51 -0.552 . . . . 74.099999999999994 109.51 -179.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 148.34 -59.59 0.46 Allowed Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 115.451 -0.795 . . . . 42.219999999999999 111.896 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 52.3 m80 -145.2 -55.1 0.31 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.8 0.333 . . . . 62.229999999999997 111.379 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' A' ' 71' ' ' LEU . 72.8 mt -133.62 153.33 51.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.336 -0.393 . . . . 74.420000000000002 110.674 -175.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.783 HH11 ' HG ' ' A' ' 77' ' ' LEU . 43.1 mtp180 -126.31 135.36 51.41 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.895 -0.409 . . . . 70.0 109.895 174.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.532 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 41.7 tt0 -68.77 110.47 4.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.04 -0.527 . . . . 74.209999999999994 109.711 177.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.5 tp -88.82 -52.18 5.25 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 111.131 -174.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.463 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 2.4 pt? -151.41 149.12 28.92 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.568 -0.287 . . . . 74.540000000000006 110.46 179.2 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -139.59 137.34 35.28 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.979 -0.378 . . . . 74.120000000000005 109.979 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.1 t -156.39 -175.7 5.57 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.143 -0.481 . . . . 73.530000000000001 109.973 -179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -106.78 -3.19 20.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.012 0.434 . . . . 71.109999999999999 110.614 179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -107.28 134.75 49.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.959 -0.564 . . . . 74.310000000000002 111.252 -176.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -93.76 -17.31 23.28 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.096 -0.502 . . . . 41.509999999999998 110.941 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t -65.24 -53.24 42.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 CA-C-O 120.926 0.393 . . . . 74.019999999999996 110.451 -178.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 28.9 tp -63.91 -34.48 78.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.189 -0.459 . . . . 74.010000000000005 110.732 179.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 66.7 mt -66.94 -32.03 73.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.447 -0.342 . . . . 51.399999999999999 111.032 179.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.9 m -67.52 -28.5 67.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.063 0.459 . . . . 74.150000000000006 110.333 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -73.87 -42.16 61.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.095 -0.502 . . . . 75.129999999999995 109.926 174.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.609 HG13 HD21 ' A' ' 84' ' ' LEU . 92.6 t -63.17 -45.35 98.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.646 -0.706 . . . . 61.100000000000001 110.721 176.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.47 -40.57 96.36 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.811 -0.632 . . . . 34.420000000000002 112.478 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.44 -33.43 74.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 72.439999999999998 111.184 179.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 87.2 mt -69.51 -51.28 37.27 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.147 0.498 . . . . 64.040000000000006 110.223 178.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.95 -47.19 81.41 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.699 -0.682 . . . . 70.25 110.815 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -66.65 -29.22 69.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 72.340000000000003 110.246 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.55 -28.56 73.11 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 121.094 -0.574 . . . . 65.430000000000007 112.32 178.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -96.45 11.8 33.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.852 0.358 . . . . 74.409999999999997 110.504 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.9 t70 66.86 19.64 10.64 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.561 -0.745 . . . . 74.049999999999997 110.89 179.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.9 mt -84.46 113.35 23.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.267 -0.424 . . . . 74.219999999999999 109.985 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.26 120.74 23.9 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 115.915 -0.584 . . . . 63.030000000000001 112.431 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -109.27 136.33 48.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.78 0.324 . . . . 75.439999999999998 110.841 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -94.38 94.77 8.46 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.007 -0.738 . . . . 62.229999999999997 109.007 176.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.419 HG22 HG22 ' A' ' 70' ' ' VAL . 20.7 t -127.78 104.86 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.728 -0.669 . . . . 62.32 110.17 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 52' ' ' LEU . 2.1 tm? -104.67 115.03 29.63 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.365 -0.606 . . . . 73.030000000000001 109.365 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -88.2 127.96 35.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.24 0.543 . . . . 62.219999999999999 109.976 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -112.24 94.11 4.77 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.961 -0.563 . . . . 54.009999999999998 109.743 -178.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 56.7 m-80 -124.25 119.41 29.26 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.845 -0.616 . . . . 74.219999999999999 110.995 -176.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 21.8 ttt -93.49 -63.12 1.24 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.964 -0.754 . . . . 75.420000000000002 108.964 174.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.7 m -161.32 143.68 12.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.323 -0.853 . . . . 71.430000000000007 108.899 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.6 tt -75.55 84.98 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.97 0.89 . . . . 63.329999999999998 110.436 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.5 tp -112.01 104.67 12.95 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.126 -0.943 . . . . 52.140000000000001 110.039 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 56.05 78.91 0.18 Allowed 'General case' 0 C--N 1.33 -0.277 0 O-C-N 123.801 0.688 . . . . 61.100000000000001 111.264 178.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.55 35.3 3.64 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.95 -0.643 . . . . 55.25 112.624 -176.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.1 m -107.69 23.17 14.88 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.471 0.653 . . . . 64.430000000000007 109.601 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.9 tp -133.9 143.74 48.44 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.178 -0.919 . . . . 74.219999999999999 109.401 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.85 78.27 0.64 Allowed Glycine 0 C--N 1.33 0.25 0 C-N-CA 121.029 -0.605 . . . . 32.409999999999997 112.533 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.654 HG12 HG12 ' A' ' 66' ' ' ILE . 23.0 t -103.69 146.28 11.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 110.255 -0.276 . . . . 72.420000000000002 110.255 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.654 HG12 HG12 ' A' ' 65' ' ' VAL . 46.1 mm 70.0 97.41 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.398 0 O-C-N 123.737 0.648 . . . . 71.310000000000002 111.602 177.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -75.63 97.03 1.07 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.823 2.349 . . . . 75.519999999999996 111.262 176.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.604 ' HA ' ' NE ' ' A' ' 68' ' ' ARG . 2.6 mmp_? -92.9 136.22 33.45 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.228 -0.442 . . . . 74.040000000000006 111.234 -176.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.1 ptt180 -145.02 144.99 31.31 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.753 -0.658 . . . . 70.340000000000003 111.0 -178.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.419 HG22 HG22 ' A' ' 51' ' ' VAL . 53.7 t -105.71 127.42 60.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.906 -0.588 . . . . 73.329999999999998 110.245 179.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.532 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 7.6 mp -113.27 137.78 50.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.153 -0.476 . . . . 70.230000000000004 110.337 178.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.7 m -104.8 160.78 5.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 116.051 -0.522 . . . . 63.340000000000003 110.572 178.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.426 ' HA ' HD23 ' A' ' 23' ' ' LEU . 70.8 m-70 -84.47 40.81 0.8 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.512 -0.313 . . . . 75.319999999999993 111.585 -176.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 67.69 -173.2 0.19 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.806 -0.634 . . . . 63.509999999999998 112.401 176.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.562 ' HA ' ' HB3' ' A' ' 16' ' ' ASN . 27.2 t70 68.57 -70.76 0.13 Allowed 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 114.678 -1.146 . . . . 61.149999999999999 112.538 177.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.18 40.22 0.54 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.832 0.349 . . . . 71.219999999999999 111.746 -175.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.783 ' HG ' HH11 ' A' ' 24' ' ' ARG . 3.7 mm? -64.29 -49.98 69.69 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.737 -0.468 . . . . 63.32 109.737 175.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.72 -33.46 70.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.852 -0.613 . . . . 55.409999999999997 110.304 178.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.46 -52.48 48.81 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.891 -0.671 . . . . 71.239999999999995 112.138 178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.42 86.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.472 0.177 . . . . 60.329999999999998 111.17 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -57.4 -48.82 78.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.487 -0.324 . . . . 64.010000000000005 111.352 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 20.8 ttm180 -67.51 -37.29 82.59 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 121.024 -0.27 . . . . 74.340000000000003 110.77 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 60.0 tp -60.62 -51.35 69.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.039 0.447 . . . . 73.109999999999999 110.52 178.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.609 HD21 HG13 ' A' ' 38' ' ' VAL . 10.5 mp -64.6 -33.79 76.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.907 -0.588 . . . . 72.129999999999995 111.326 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.824 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 95.3 m -66.92 -44.04 81.72 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.345 -0.389 . . . . 73.430000000000007 110.639 178.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -68.04 -35.29 78.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 71.219999999999999 110.136 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.57 -44.77 93.19 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.765 -0.652 . . . . 72.540000000000006 111.16 177.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 127.21 -14.78 6.52 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.228 -0.987 . . . . 70.030000000000001 113.602 175.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.511 HD11 ' HG ' ' A' ' 84' ' ' LEU . 1.6 pp -94.79 19.32 10.27 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.321 0.489 . . . . 64.310000000000002 112.321 -175.362 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.834 ' HA ' HD13 ' A' ' 93' ' ' LEU . . . -68.63 84.54 0.29 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.94 0.4 . . . . 74.319999999999993 110.51 176.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -145.77 -48.05 0.22 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.839 -0.618 . . . . 72.040000000000006 109.883 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -79.87 -7.63 58.83 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.021 0.439 . . . . 62.32 110.543 -179.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.834 HD13 ' HA ' ' A' ' 90' ' ' ALA . 7.1 mp -67.09 134.83 52.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.891 -0.595 . . . . 73.030000000000001 110.094 178.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 28.8 tpt180 -131.99 112.59 12.52 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.094 0.473 . . . . 54.240000000000002 110.869 -177.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 49.1 m -118.47 107.37 13.72 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.731 -0.47 . . . . 63.539999999999999 109.731 175.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -76.52 132.97 39.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.273 -0.421 . . . . 73.150000000000006 110.493 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 12.6 t70 . . . . . 0 C--O 1.247 0.969 0 O-C-N 124.192 0.932 . . . . 74.150000000000006 109.851 -177.397 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 mpp? . . . . . 0 N--CA 1.478 0.941 0 CA-C-O 120.769 0.319 . . . . 62.32 110.337 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 95.25 89.69 1.74 Allowed Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.915 -0.659 . . . . 64.209999999999994 111.594 -178.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.3 m -70.36 104.7 2.78 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.026 0.441 . . . . 73.340000000000003 110.733 -178.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.2 p -120.15 129.53 54.18 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 116.002 -0.544 . . . . 44.229999999999997 111.174 -177.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -147.48 20.62 1.19 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.635 -0.712 . . . . 72.329999999999998 109.677 174.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 45.9 m80 -109.53 116.94 32.71 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.042 -0.981 . . . . 72.310000000000002 110.744 179.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -132.66 116.76 17.05 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.844 -0.798 . . . . 72.010000000000005 108.844 170.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -142.86 126.44 16.87 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.871 -0.604 . . . . 72.400000000000006 111.091 -169.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -176.91 154.76 1.15 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.956 -0.565 . . . . 74.409999999999997 110.217 174.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -153.31 89.12 1.33 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.19 0.519 . . . . 62.340000000000003 109.682 175.318 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 14.3 p -75.07 143.27 43.53 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.771 -0.649 . . . . 72.140000000000001 111.091 -175.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.4 m -144.78 96.33 2.84 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 74.099999999999994 110.231 178.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -177.72 127.52 1.19 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 121.011 -0.614 . . . . 62.409999999999997 111.675 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 ttp180 -151.22 -31.12 0.17 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.915 0.388 . . . . 75.540000000000006 110.642 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -83.33 125.28 31.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.335 -0.393 . . . . 70.400000000000006 110.042 178.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.9 p-10 -148.9 65.25 1.04 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.477 0.656 . . . . 71.310000000000002 110.737 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.5 mp -99.34 116.23 31.04 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.842 -0.617 . . . . 71.219999999999999 110.21 -179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -77.28 80.91 3.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.275 0.559 . . . . 74.549999999999997 110.909 179.654 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -134.63 83.76 2.06 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.589 -0.732 . . . . 72.530000000000001 110.238 177.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -93.62 -17.76 22.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.373 0.606 . . . . 74.510000000000005 110.098 177.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.432 ' O ' ' HB3' ' A' ' 22' ' ' HIS . . . -104.19 -172.32 25.15 Favored Glycine 0 N--CA 1.446 -0.672 0 N-CA-C 110.897 -0.881 . . . . 61.020000000000003 110.897 177.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.432 ' HB3' ' O ' ' A' ' 21' ' ' GLY . 44.6 t60 73.25 121.03 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.113 0.483 . . . . 64.420000000000002 110.545 178.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.1 mp -112.7 146.41 38.76 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.301 -0.408 . . . . 71.519999999999996 110.524 -179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.401 ' O ' ' HA ' ' A' ' 71' ' ' LEU . 66.9 mtt180 -113.66 144.42 42.94 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.705 -0.48 . . . . 72.140000000000001 109.705 175.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.531 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 80.3 tt0 -77.11 110.59 11.91 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.783 -1.191 . . . . 72.239999999999995 107.783 172.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.557 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -79.92 -52.62 7.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.941 -0.572 . . . . 62.539999999999999 110.075 -173.011 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.655 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . 2.1 pt? -152.52 150.72 29.88 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.735 -0.666 . . . . 71.409999999999997 109.491 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.481 ' HD2' ' OE2' ' A' ' 25' ' ' GLU . 8.7 ptm85 -132.53 121.56 23.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.282 0.563 . . . . 72.230000000000004 110.206 176.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.8 t -119.25 168.87 10.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.507 -0.77 . . . . 73.129999999999995 110.625 -175.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -117.05 7.96 13.24 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.54 -0.541 . . . . 73.430000000000007 109.54 174.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -105.38 142.43 35.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.4 -0.818 . . . . 72.430000000000007 110.134 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.443 ' HA ' HD12 ' A' ' 35' ' ' LEU . . . -94.94 -24.4 16.99 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.453 -0.339 . . . . 74.340000000000003 111.63 -175.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.5 t -77.99 -36.37 21.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.142 0.496 . . . . 71.340000000000003 110.137 -176.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 63.6 tp -61.16 -34.61 75.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.589 -0.732 . . . . 75.310000000000002 110.304 175.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.74 HD11 ' HG3' ' A' ' 68' ' ' ARG . 87.7 mt -63.26 -35.45 80.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.88 -0.6 . . . . 64.230000000000004 110.885 178.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.0 m -68.29 -27.66 66.5 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.218 0.532 . . . . 62.32 110.632 178.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.18 -51.11 8.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.852 -0.613 . . . . 54.100000000000001 110.804 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.487 HG12 ' HA ' ' A' ' 35' ' ' LEU . 9.8 p -65.8 -34.26 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 116.25 -0.432 . . . . 52.119999999999997 110.514 -179.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -63.21 -48.03 83.0 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 121.08 -0.581 . . . . 63.119999999999997 112.557 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.72 -25.26 67.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.107 0.48 . . . . 72.040000000000006 111.243 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.557 ' HB3' HD21 ' A' ' 83' ' ' LEU . 94.4 mt -75.6 -52.37 10.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.055 -0.52 . . . . 73.049999999999997 110.075 177.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.27 -49.15 75.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.748 -0.66 . . . . 74.310000000000002 111.104 -179.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -63.6 -28.17 69.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.396 -0.365 . . . . 65.25 110.803 -178.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -73.44 -18.56 79.41 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.799 -0.715 . . . . 45.340000000000003 112.573 179.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -114.41 15.43 17.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.707 0.262 . . . . 63.43 111.707 -176.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.9 t70 71.45 7.35 6.01 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.426 0.631 . . . . 73.129999999999995 111.544 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 58.5 mt -70.96 112.09 5.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.169 -0.469 . . . . 74.409999999999997 111.01 -176.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -64.68 130.95 37.22 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.844 -0.616 . . . . 51.219999999999999 112.015 177.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 19.6 p80 -138.41 147.35 43.25 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.708 0.289 . . . . 72.129999999999995 110.769 -177.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.485 HD12 ' HB2' ' A' ' 71' ' ' LEU . 77.3 mt -82.8 -65.92 0.95 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.092 -0.503 . . . . 70.430000000000007 110.996 176.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 54.5 t 64.15 78.9 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 121.875 0.845 . . . . 63.32 110.602 -177.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 pp -170.92 -166.18 0.47 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.491 -1.231 . . . . 72.140000000000001 107.776 -179.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -167.66 -82.86 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.404 -0.591 . . . . 71.140000000000001 109.404 172.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.3 tm0? -103.5 107.17 17.9 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.346 -0.983 . . . . 75.310000000000002 108.346 174.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -73.68 121.36 20.62 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.707 -0.479 . . . . 73.109999999999999 109.707 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.6 ' HB3' ' HA3' ' A' ' 61' ' ' GLY . 23.4 ptt? -51.29 113.28 0.9 Allowed 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.458 0.647 . . . . 71.340000000000003 110.191 178.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.72 ' HB2' HD12 ' A' ' 58' ' ' ILE . 19.7 m -109.49 -61.14 1.68 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.498 -0.774 . . . . 75.219999999999999 111.568 -171.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.72 HD12 ' HB2' ' A' ' 57' ' ' SER . 4.8 mp -94.55 -73.9 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.98 0.419 . . . . 63.32 111.415 -171.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 68.1 tp -121.84 -53.51 1.96 Allowed 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.424 -0.353 . . . . 72.150000000000006 111.797 -171.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.78 160.07 16.26 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.34 0.591 . . . . 71.519999999999996 111.464 -172.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.6 ' HA3' ' HB3' ' A' ' 56' ' ' MET . . . 161.37 14.56 0.03 OUTLIER Glycine 0 N--CA 1.442 -0.919 0 CA-C-N 114.773 -1.103 . . . . 74.019999999999996 111.441 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 61' ' ' GLY . 32.6 p -139.93 -39.94 0.45 Allowed 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.935 0.346 . . . . 75.25 111.935 -177.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.3 mp -72.89 -42.51 63.52 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.731 0.3 . . . . 71.140000000000001 111.227 -176.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.45 -178.81 46.18 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.038 -0.601 . . . . 50.140000000000001 112.559 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.0 t -97.01 93.38 3.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.179 0.514 . . . . 75.219999999999999 109.979 -179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.3 mp -92.31 119.49 68.1 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.777 -0.647 . . . . 61.409999999999997 109.773 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -63.64 167.31 13.69 Favored 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.901 2.401 . . . . 73.450000000000003 111.89 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.74 ' HG3' HD11 ' A' ' 35' ' ' LEU . 13.3 mmt85 -130.02 122.52 28.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.186 -0.301 . . . . 72.400000000000006 110.186 -177.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.721 ' HD3' HD11 ' A' ' 71' ' ' LEU . 1.8 ptp180 -112.66 136.44 52.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.196 0.522 . . . . 74.299999999999997 110.402 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 48.2 t -106.97 111.64 36.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.991 -0.55 . . . . 52.340000000000003 110.162 179.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.721 HD11 ' HD3' ' A' ' 69' ' ' ARG . 7.6 mp -104.62 139.78 38.97 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.34 -0.391 . . . . 75.409999999999997 110.253 177.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 28.8 m -130.27 168.68 22.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 O-C-N 123.73 0.644 . . . . 74.450000000000003 110.038 177.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 -82.38 163.22 21.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.292 -0.413 . . . . 63.340000000000003 110.83 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -59.45 -27.07 65.74 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.293 -0.412 . . . . 62.530000000000001 110.169 174.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -43.41 -59.12 2.26 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.218 -0.901 . . . . 74.5 111.781 179.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -116.79 35.42 4.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.181 -0.463 . . . . 74.340000000000003 110.31 -175.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.496 ' O ' ' HG3' ' A' ' 81' ' ' ARG . 0.2 OUTLIER -59.71 -53.89 52.69 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.363 -0.606 . . . . 73.120000000000005 109.363 178.675 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.48 -30.34 69.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.977 -0.556 . . . . 41.43 110.704 179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.87 -49.32 49.36 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.802 -0.635 . . . . 62.32 112.389 -179.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.75 -39.51 93.75 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.387 0.137 . . . . 62.399999999999999 110.71 178.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 77' ' ' LEU . 73.5 mtp180 -57.66 -47.92 80.94 Favored 'General case' 0 C--N 1.333 -0.148 0 N-CA-C 110.088 -0.338 . . . . 72.430000000000007 110.088 175.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 82' ' ' ARG . 3.8 tpp180 -58.12 -50.9 71.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.79 -0.641 . . . . 73.219999999999999 110.494 178.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.557 HD21 ' HB3' ' A' ' 41' ' ' LEU . 55.7 tp -58.35 -52.18 66.69 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.529 -0.76 . . . . 75.209999999999994 111.856 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.98 -33.43 73.68 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.624 0.25 . . . . 73.420000000000002 111.643 -177.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.969 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 53.4 m -73.3 -36.67 66.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.1 0.476 . . . . 45.130000000000003 110.633 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -74.53 -32.79 62.58 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.83 -0.623 . . . . 71.430000000000007 110.3 179.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -62.3 -44.57 96.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.776 -0.647 . . . . 72.5 111.807 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 150.94 -47.4 0.59 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 119.76 -1.21 . . . . 73.010000000000005 113.622 177.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.825 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.7 OUTLIER -53.58 -75.77 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.7 0.25 . . . . 74.230000000000004 111.504 -175.014 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.969 ' HB2' ' HA ' ' A' ' 85' ' ' THR . . . 42.2 38.89 1.24 Allowed 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.573 0.582 . . . . 53.229999999999997 112.573 178.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 29.5 t-80 -132.78 -46.44 0.87 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.385 0.612 . . . . 73.510000000000005 110.375 -176.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 19.9 mp0 -71.09 -13.25 61.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.038 -0.983 . . . . 73.030000000000001 110.892 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.655 ' HA ' ' HB3' ' A' ' 27' ' ' LEU . 6.7 mp -66.13 96.0 0.31 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.881 -0.6 . . . . 72.450000000000003 110.131 -179.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -178.67 135.28 0.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.043 -0.526 . . . . 63.240000000000002 110.577 -172.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 21.5 m -159.1 -47.24 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.844 0.354 . . . . 54.109999999999999 111.819 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -80.78 6.26 13.49 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.209 0.528 . . . . 73.219999999999999 111.421 -174.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 33.3 t70 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 117.979 -1.01 . . . . 65.329999999999998 110.217 -177.337 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttt . . . . . 0 N--CA 1.481 1.078 0 CA-C-O 121.169 0.509 . . . . 71.109999999999999 110.109 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -174.97 54.71 0.13 Allowed Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 110.865 -0.894 . . . . 64.340000000000003 110.865 178.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.4 p -90.77 -4.52 56.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.49 -0.355 . . . . 73.549999999999997 111.888 -173.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.2 p -76.35 71.86 3.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.114 0.483 . . . . 74.310000000000002 112.238 -175.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -163.35 121.22 1.92 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.139 0.495 . . . . 75.299999999999997 111.49 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.6 m80 -118.56 -113.81 0.33 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 107.434 -1.321 . . . . 62.109999999999999 107.434 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 43.6 t-80 62.91 28.44 16.34 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.174 0.512 . . . . 63.030000000000001 111.815 166.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -114.48 105.39 13.05 Favored 'General case' 0 C--N 1.329 -0.31 0 O-C-N 121.699 -0.626 . . . . 65.349999999999994 111.558 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 27.4 p80 -160.81 126.63 3.9 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.917 -0.401 . . . . 60.439999999999998 109.917 170.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.4 t-160 -160.31 70.08 0.41 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.226 0.536 . . . . 70.340000000000003 109.689 178.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 p -99.38 101.36 12.6 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.738 -0.664 . . . . 54.329999999999998 110.607 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.6 m -152.2 86.27 1.29 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.334 -0.394 . . . . 45.210000000000001 110.558 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -132.6 37.27 2.05 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.858 -0.687 . . . . 61.240000000000002 111.938 179.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 52.0 mtt180 -101.97 36.0 2.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.082 0.468 . . . . 75.030000000000001 110.218 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -83.67 115.65 22.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.754 -0.657 . . . . 70.230000000000004 110.458 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -171.02 85.85 0.1 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.615 -0.721 . . . . 62.030000000000001 109.307 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -159.37 106.95 1.76 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.762 -0.829 . . . . 71.450000000000003 108.762 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 78.8 t80 -157.87 95.25 1.39 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.918 0.389 . . . . 72.430000000000007 110.869 -177.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -97.03 104.91 16.97 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.396 -0.594 . . . . 72.140000000000001 109.396 175.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -90.49 137.15 32.58 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.185 0.517 . . . . 72.340000000000003 110.901 -175.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 176.65 -139.19 4.36 Favored Glycine 0 N--CA 1.442 -0.903 0 N-CA-C 110.39 -1.084 . . . . 62.130000000000003 110.39 179.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -143.09 -170.12 3.18 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 117.024 0.412 . . . . 73.329999999999998 110.3 175.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.468 ' HB3' HD23 ' A' ' 71' ' ' LEU . 95.3 mt -58.03 116.94 3.83 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-N 116.212 -0.449 . . . . 51.240000000000002 111.555 -175.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 50.3 mmm-85 -106.09 132.99 51.51 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.722 -0.672 . . . . 74.040000000000006 109.87 177.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.544 ' HA ' ' HG ' ' A' ' 71' ' ' LEU . 22.3 tt0 -80.31 110.69 15.99 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.291 -0.633 . . . . 74.200000000000003 109.291 -179.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.671 ' HB3' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -84.62 -55.0 4.35 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.051 -0.522 . . . . 55.329999999999998 110.667 -172.597 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.782 ' HB3' HD23 ' A' ' 93' ' ' LEU . 1.2 pt? -142.59 153.99 44.01 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.14 -0.482 . . . . 72.329999999999998 110.689 -179.023 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 28' ' ' ARG . 4.7 tmm_? -139.98 130.8 25.97 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.324 -0.853 . . . . 71.319999999999993 109.07 -178.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.0 t -167.11 175.5 7.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 110.118 -0.327 . . . . 60.439999999999998 110.118 178.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.418 ' HB3' HG11 ' A' ' 65' ' ' VAL . 12.8 m120 -119.53 4.07 11.17 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.368 -0.378 . . . . 64.319999999999993 110.202 -179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -85.6 108.27 17.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 54.130000000000003 110.353 -178.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.62 -35.91 81.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.728 -0.669 . . . . 75.430000000000007 111.52 -176.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 50.7 t -62.06 -51.95 66.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 CA-C-O 120.911 0.386 . . . . 65.129999999999995 110.437 -178.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.558 HD11 HD13 ' A' ' 89' ' ' LEU . 32.9 tp -64.45 -42.13 96.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.989 -0.55 . . . . 72.219999999999999 110.853 -179.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.404 HD13 ' HD2' ' A' ' 68' ' ' ARG . 62.1 mt -59.35 -38.95 81.69 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.778 0.323 . . . . 60.200000000000003 111.201 178.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 m -66.43 -38.72 88.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.918 0.39 . . . . 74.200000000000003 110.496 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.58 ' O ' ' HG ' ' A' ' 41' ' ' LEU . . . -65.29 -46.52 80.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 60.219999999999999 110.288 177.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.555 HG13 HD21 ' A' ' 84' ' ' LEU . 95.5 t -59.59 -43.54 91.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.129 -0.487 . . . . 65.420000000000002 110.751 178.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -59.22 -43.68 97.01 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.985 -0.626 . . . . 74.219999999999999 111.918 178.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.47 -36.08 82.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.721 0.296 . . . . 50.43 110.886 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 37' ' ' ALA . 94.2 mt -65.35 -52.29 54.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.004 0.431 . . . . 63.520000000000003 110.395 178.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.0 mt -64.53 -36.73 85.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.808 -0.633 . . . . 75.239999999999995 110.859 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -65.1 -39.96 93.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.029 -0.532 . . . . 72.109999999999999 110.305 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.61 -21.43 74.67 Favored Glycine 0 CA--C 1.518 0.239 0 CA-C-N 115.804 -0.635 . . . . 73.349999999999994 112.876 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -101.63 0.66 36.63 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.957 0.408 . . . . 65.430000000000007 110.338 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 t70 59.59 30.09 19.7 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.27 -0.877 . . . . 74.219999999999999 111.253 178.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 65.2 mt -79.67 114.83 21.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-N 115.962 -0.563 . . . . 72.319999999999993 110.158 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.21 110.87 2.71 Favored Glycine 0 N--CA 1.453 -0.195 0 CA-C-N 116.06 -0.518 . . . . 60.399999999999999 112.183 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 54.2 p-80 -131.36 137.86 48.92 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.71 0.29 . . . . 73.120000000000005 110.808 -175.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 92.8 mt -112.63 146.55 38.42 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.665 -0.495 . . . . 73.540000000000006 109.665 177.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.629 HG23 ' HG ' ' A' ' 52' ' ' LEU . 16.7 m -140.25 -164.22 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.486 -0.325 . . . . 74.109999999999999 110.452 -176.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.629 ' HG ' HG23 ' A' ' 51' ' ' VAL . 96.5 mt 75.89 -168.78 0.08 Allowed 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.926 0.766 . . . . 61.32 111.744 175.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -177.17 -56.78 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 107.939 -1.134 . . . . 74.549999999999997 107.939 -179.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -134.69 137.59 43.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.388 -1.278 . . . . 75.329999999999998 108.426 170.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -119.36 153.86 34.48 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.029 0.442 . . . . 74.519999999999996 111.39 -175.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 50.6 ttp -171.43 150.02 2.79 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.5 -0.926 . . . . 61.0 108.5 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 61.8 m -62.46 126.82 28.64 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.754 -0.378 . . . . 72.25 110.077 174.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.431 ' O ' ' HB2' ' A' ' 59' ' ' LEU . 38.5 mm -82.32 -21.39 9.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 73.040000000000006 110.447 -175.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 58' ' ' ILE . 57.2 mt 70.28 -74.92 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.03 -0.987 . . . . 52.329999999999998 111.192 -178.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -168.38 -28.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.448 -0.342 . . . . 74.129999999999995 111.051 -178.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 176.98 127.36 1.04 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.571 -0.823 . . . . 73.209999999999994 112.383 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.0 t -159.45 165.31 33.38 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.505 -0.554 . . . . 65.519999999999996 109.505 178.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.0 mp -84.41 113.8 21.44 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.991 0.424 . . . . 64.209999999999994 110.764 -178.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 147.99 98.07 0.2 Allowed Glycine 0 N--CA 1.443 -0.855 0 C-N-CA 120.908 -0.663 . . . . 43.539999999999999 111.761 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.418 HG11 ' HB3' ' A' ' 30' ' ' ASN . 61.3 t -95.14 122.05 46.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 109.9 -0.407 . . . . 64.209999999999994 109.9 -179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.3 mp -84.42 119.51 73.14 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.335 -0.393 . . . . 51.520000000000003 109.973 179.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -61.85 102.27 0.24 Allowed 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.761 2.307 . . . . 52.409999999999997 111.656 177.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.404 ' HD2' HD13 ' A' ' 35' ' ' LEU . 40.3 ttm180 -105.58 112.48 25.58 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.647 -0.706 . . . . 74.510000000000005 110.212 -176.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.415 ' HG3' ' OE1' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -115.39 158.97 21.7 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.007 -0.542 . . . . 62.509999999999998 109.842 176.799 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.441 ' HA ' HG12 ' A' ' 51' ' ' VAL . 21.4 t -109.24 118.09 55.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.406 -0.361 . . . . 74.239999999999995 110.747 -175.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.544 ' HG ' ' HA ' ' A' ' 25' ' ' GLU . 8.3 mp -107.88 132.49 53.4 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.206 -0.452 . . . . 71.420000000000002 109.794 177.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 15.3 m -92.77 142.86 12.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 120.878 0.37 . . . . 43.509999999999998 110.738 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -88.18 61.2 6.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.104 -0.498 . . . . 74.230000000000004 110.477 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 55.85 -169.25 0.09 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.215 -0.902 . . . . 64.439999999999998 112.217 178.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.4 t70 64.32 -72.59 0.06 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.924 0.889 . . . . 65.109999999999999 112.328 177.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.608 ' OD1' ' HA3' ' A' ' 79' ' ' GLY . 0.4 OUTLIER -88.93 36.53 0.81 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.187 0.517 . . . . 73.019999999999996 110.577 -175.473 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.39 -51.18 70.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.617 -0.719 . . . . 75.310000000000002 110.419 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -72.41 -27.72 62.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.714 -0.675 . . . . 63.32 110.244 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.608 ' HA3' ' OD1' ' A' ' 76' ' ' ASP . . . -61.67 -52.87 47.94 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.649 -0.705 . . . . 60.009999999999998 112.424 -178.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.96 97.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.629 0.252 . . . . 71.439999999999998 111.088 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 81.4 mtp180 -59.16 -41.85 89.35 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.094 0.473 . . . . 64.209999999999994 110.63 178.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.464 ' HA ' ' HE ' ' A' ' 82' ' ' ARG . 0.3 OUTLIER -68.89 -49.62 56.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.621 -0.718 . . . . 61.119999999999997 110.809 179.545 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 49.6 tp -56.27 -48.99 75.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.519 -0.764 . . . . 74.510000000000005 112.074 -173.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.555 HD21 HG13 ' A' ' 38' ' ' VAL . 11.1 mp -67.66 -27.37 66.8 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.651 -0.249 . . . . 74.019999999999996 111.211 -178.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.762 ' HA ' ' HB2' ' A' ' 90' ' ' ALA . 61.2 m -70.97 -43.48 67.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.396 -0.365 . . . . 74.239999999999995 110.264 175.114 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -62.77 -39.79 95.29 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.999 -0.546 . . . . 72.099999999999994 110.764 176.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -57.86 -43.47 85.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.801 -0.636 . . . . 75.409999999999997 111.465 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 140.08 -43.37 1.14 Allowed Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 119.939 -1.124 . . . . 73.200000000000003 113.433 176.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.873 ' HG ' ' H ' ' A' ' 90' ' ' ALA . 0.6 OUTLIER -58.93 -75.94 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 111.654 0.242 . . . . 74.219999999999999 111.654 -175.299 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.873 ' H ' ' HG ' ' A' ' 89' ' ' LEU . . . 44.69 44.46 7.49 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 122.772 0.429 . . . . 54.420000000000002 111.548 -177.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -116.55 -56.02 2.32 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 120.893 -0.323 . . . . 74.239999999999995 111.467 -173.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -76.81 10.25 2.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.299 -0.41 . . . . 73.120000000000005 111.235 -177.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.782 HD23 ' HB3' ' A' ' 27' ' ' LEU . 63.2 mt -80.52 117.8 21.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.433 . . . . 70.129999999999995 110.273 -178.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -99.64 79.17 2.22 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.226 -0.657 . . . . 73.219999999999999 109.226 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.0 m -63.14 -31.15 72.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.38 -0.827 . . . . 52.219999999999999 111.497 -175.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -167.14 -38.46 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.158 0.504 . . . . 73.200000000000003 110.362 179.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.591 -0.718 . . . . 73.239999999999995 110.313 -178.281 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttp . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 120.76 0.314 . . . . 62.240000000000002 110.542 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 98.24 86.59 1.86 Allowed Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.8 -0.714 . . . . 72.099999999999994 111.707 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 41.1 m -116.06 118.56 33.21 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.779 0.323 . . . . 51.329999999999998 110.844 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.6 m -104.39 114.07 28.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.638 -0.504 . . . . 43.329999999999998 109.638 176.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -137.84 105.78 5.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.238 0.542 . . . . 73.420000000000002 111.624 -176.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -142.99 95.0 2.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.45 -0.795 . . . . 73.310000000000002 109.802 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -75.14 149.52 39.01 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.467 -0.788 . . . . 75.519999999999996 110.904 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -167.91 128.94 1.41 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 121.218 0.532 . . . . 73.310000000000002 111.061 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 24.5 p-80 -145.22 75.92 1.46 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.795 0.807 . . . . 71.420000000000002 109.754 175.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -81.54 87.59 6.23 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.737 -0.665 . . . . 65.439999999999998 111.571 -171.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.1 m -130.67 123.57 29.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.851 -0.796 . . . . 72.25 108.851 173.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.3 t -135.92 104.31 5.68 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.484 0.55 . . . . 72.409999999999997 112.484 -175.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 72.37 -167.53 53.23 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.285 -0.871 . . . . 75.120000000000005 114.917 167.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -172.99 -176.62 1.44 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 114.508 -0.846 . . . . 65.530000000000001 108.981 -178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -143.96 153.13 41.95 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.354 -0.239 . . . . 75.329999999999998 110.354 177.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -161.82 115.69 1.89 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.099 -0.5 . . . . 61.43 109.794 -179.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.2 mt -114.11 100.77 8.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.174 0.511 . . . . 71.230000000000004 112.066 -175.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -127.37 149.36 50.1 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.708 -0.678 . . . . 74.420000000000002 109.618 171.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.0 p90 -137.67 131.1 30.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.971 0.415 . . . . 63.109999999999999 110.754 178.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 47.3 tp60 -168.05 87.89 0.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.107 -0.701 . . . . 72.239999999999995 109.107 -179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -106.7 78.01 0.24 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.88 -0.676 . . . . 72.349999999999994 113.818 -171.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.5 m80 -141.25 169.88 16.77 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.806 -0.813 . . . . 72.430000000000007 108.806 172.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.553 HD22 HD12 ' A' ' 50' ' ' LEU . 5.8 mp -130.61 130.35 43.88 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.85 -0.426 . . . . 75.030000000000001 109.85 176.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.3 mtt180 -122.06 169.27 11.02 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.299 -0.41 . . . . 75.109999999999999 110.218 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -67.89 120.72 14.64 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.28 -0.418 . . . . 63.340000000000003 111.384 178.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.634 HD12 HD22 ' A' ' 27' ' ' LEU . 1.8 tm? -74.62 -36.41 62.94 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 107.254 -1.388 . . . . 54.310000000000002 107.254 169.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.634 HD22 HD12 ' A' ' 26' ' ' LEU . 2.5 pt? -176.81 159.99 1.84 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.186 -0.915 . . . . 71.540000000000006 110.195 -175.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.447 ' NH1' ' HB3' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -110.07 112.02 23.74 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.081 -1.081 . . . . 74.439999999999998 108.081 170.125 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.686 HG22 ' H ' ' A' ' 32' ' ' ALA . 11.2 m -85.13 109.22 18.11 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.104 -0.498 . . . . 73.310000000000002 111.237 -171.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.447 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 0.6 OUTLIER -90.51 -15.04 31.49 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.125 -0.694 . . . . 74.340000000000003 109.125 176.569 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -73.14 -32.48 64.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.12 -0.945 . . . . 71.430000000000007 110.873 179.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.686 ' H ' HG22 ' A' ' 29' ' ' THR . . . 74.25 -40.27 0.45 Allowed 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.703 0.801 . . . . 73.299999999999997 112.586 178.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 48.1 t -78.91 -39.99 22.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.051 0.453 . . . . 75.319999999999993 110.805 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.404 ' O ' HG23 ' A' ' 38' ' ' VAL . 55.5 tp -52.79 -39.84 62.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.681 -0.691 . . . . 63.119999999999997 112.266 -178.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 32' ' ' ALA . 4.5 pp -65.23 -25.2 67.58 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 111.651 0.241 . . . . 73.019999999999996 111.651 -175.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.1 m -70.67 -34.03 71.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.099 0.476 . . . . 74.040000000000006 109.958 178.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -76.33 -40.91 50.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.974 -0.557 . . . . 73.25 110.044 176.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.425 HG13 HD21 ' A' ' 84' ' ' LEU . 75.1 t -57.24 -36.34 51.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 115.606 -0.725 . . . . 73.140000000000001 110.799 177.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -60.99 -46.03 95.41 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.596 -0.729 . . . . 70.439999999999998 112.433 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.34 -26.6 65.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.913 0.387 . . . . 62.200000000000003 111.201 -179.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.32 -52.12 13.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.395 -0.366 . . . . 74.230000000000004 110.977 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.539 HD23 HD23 ' A' ' 83' ' ' LEU . 63.7 mt -69.45 -39.45 77.76 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.218 -0.446 . . . . 75.239999999999995 111.401 -175.053 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -30.54 60.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.586 -0.279 . . . . 60.219999999999999 111.117 178.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.51 -26.67 73.6 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.038 -0.601 . . . . 63.009999999999998 111.796 177.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -90.45 5.58 46.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.597 0.237 . . . . 53.210000000000001 110.876 178.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.1 t70 70.61 7.68 6.3 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.84 -0.618 . . . . 74.030000000000001 111.217 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 66.0 mt -75.2 -45.36 41.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.254 0.549 . . . . 63.119999999999997 110.696 -178.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.01 148.21 23.86 Favored Glycine 0 C--N 1.315 -0.588 0 CA-C-N 115.285 -0.871 . . . . 50.229999999999997 111.854 -179.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -142.66 139.78 31.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.291 -0.263 . . . . 70.530000000000001 110.291 -178.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.553 HD12 HD22 ' A' ' 23' ' ' LEU . 71.0 mt -119.02 106.73 12.71 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.826 0.346 . . . . 72.409999999999997 110.469 175.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.599 HG22 HG22 ' A' ' 70' ' ' VAL . 59.0 t -84.71 112.78 22.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.046 -0.724 . . . . 75.349999999999994 109.046 174.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 50.3 tp -105.94 114.39 28.51 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.021 -0.536 . . . . 64.329999999999998 110.834 -175.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.411 ' CB ' ' HG2' ' A' ' 68' ' ' ARG . 8.5 p-10 -155.94 -170.22 3.33 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.311 -0.859 . . . . 75.329999999999998 109.279 176.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -99.88 100.2 11.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.025 0.441 . . . . 64.019999999999996 109.998 179.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -81.96 35.61 0.43 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.033 -0.53 . . . . 53.130000000000003 111.412 -174.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.404 ' O ' ' HG2' ' A' ' 56' ' ' MET . 22.3 ttt -155.18 20.24 0.43 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.186 0.517 . . . . 63.229999999999997 110.516 179.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.3 m -75.1 113.0 11.93 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.092 0.473 . . . . 72.510000000000005 110.533 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 5.4 tp -114.03 103.51 15.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.775 0.797 . . . . 74.219999999999999 110.653 -179.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 59' ' ' LEU . 1.0 OUTLIER -122.8 130.68 53.19 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.324 -0.991 . . . . 74.010000000000005 108.324 177.87 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.417 ' N ' HD13 ' A' ' 59' ' ' LEU . 7.5 pt-20 -65.2 97.51 0.26 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.646 0.736 . . . . 74.530000000000001 111.602 -178.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 139.13 156.69 7.06 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.353 -0.839 . . . . 51.299999999999997 111.842 178.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 25.5 m -96.69 82.76 3.35 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.374 0.607 . . . . 73.519999999999996 110.34 179.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.6 tp -139.5 116.24 10.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.515 -0.766 . . . . 72.129999999999995 109.953 -177.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.88 102.45 2.14 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.864 -0.684 . . . . 40.25 111.968 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.4 t -116.39 -0.05 8.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.361 0.6 . . . . 71.510000000000005 110.327 -178.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.403 HD12 ' N ' ' A' ' 66' ' ' ILE . 4.0 mp -101.47 107.67 52.09 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.247 -0.433 . . . . 74.420000000000002 110.212 -178.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -74.2 93.22 0.89 Allowed 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.407 2.072 . . . . 75.340000000000003 111.464 176.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.411 ' HG2' ' CB ' ' A' ' 53' ' ' ASP . 86.7 mtt180 -72.58 133.55 44.77 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.707 -0.679 . . . . 64.109999999999999 110.223 -177.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 57.2 mtt85 -113.97 135.1 54.37 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.999 -0.546 . . . . 72.329999999999998 111.765 -171.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.599 HG22 HG22 ' A' ' 51' ' ' VAL . 45.0 t -101.98 116.55 45.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.913 -0.585 . . . . 73.209999999999994 109.666 177.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 10.6 mp -101.95 142.98 32.39 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.793 0.33 . . . . 53.340000000000003 110.546 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.447 HG23 ' HB2' ' A' ' 26' ' ' LEU . 3.0 t -126.29 154.25 35.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.9 -0.591 . . . . 45.109999999999999 109.882 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -59.14 139.06 57.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.99 -0.55 . . . . 73.540000000000006 109.637 174.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.411 ' O ' ' HB3' ' A' ' 75' ' ' ASP . 38.1 mt-10 -57.53 156.43 8.16 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.969 -0.292 . . . . 71.129999999999995 110.387 178.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.411 ' HB3' ' O ' ' A' ' 74' ' ' GLU . 28.7 t70 73.05 -47.5 0.67 Allowed 'General case' 0 N--CA 1.468 0.471 0 O-C-N 123.935 0.772 . . . . 54.530000000000001 110.376 -173.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -73.85 -16.13 61.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.787 -0.82 . . . . 64.439999999999998 108.787 175.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.425 HD22 HD23 ' A' ' 26' ' ' LEU . 1.1 tm? -55.57 -45.83 77.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.524 -1.216 . . . . 72.209999999999994 109.659 174.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.06 -38.16 89.91 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 71.329999999999998 110.987 179.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -67.62 -44.41 82.13 Favored Glycine 0 C--N 1.329 0.181 0 C-N-CA 120.971 -0.633 . . . . 61.43 111.829 177.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.408 ' O ' ' HG ' ' A' ' 84' ' ' LEU . . . -59.54 -39.78 85.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.77 0.319 . . . . 14.43 110.683 177.281 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.4 mtp180 -55.35 -52.91 61.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.89 -0.596 . . . . 75.329999999999998 110.947 176.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -62.3 -43.49 98.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 75.329999999999998 110.754 -177.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.539 HD23 HD23 ' A' ' 42' ' ' LEU . 50.1 tp -59.28 -47.11 86.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.641 -0.708 . . . . 74.450000000000003 111.035 -179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.425 HD21 HG13 ' A' ' 38' ' ' VAL . 66.4 mt -72.01 -26.11 62.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.073 -0.512 . . . . 75.340000000000003 111.588 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 56.4 m -68.0 -48.3 66.13 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.584 -0.28 . . . . 75.040000000000006 110.423 176.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -65.64 -42.09 91.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.86 0.362 . . . . 73.439999999999998 110.698 178.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -119.42 82.21 1.84 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.099 0.476 . . . . 71.329999999999998 111.136 -179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 154.3 -95.69 0.15 Allowed Glycine 0 N--CA 1.44 -1.091 0 N-CA-C 111.384 -0.686 . . . . 34.130000000000003 111.384 178.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.559 HD12 ' N ' ' A' ' 90' ' ' ALA . 1.7 pp 175.12 -35.28 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.763 0.425 . . . . 62.520000000000003 110.662 -177.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.559 ' N ' HD12 ' A' ' 89' ' ' LEU . . . 48.39 54.12 10.9 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.707 -0.679 . . . . 61.299999999999997 112.185 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -99.8 -34.64 10.07 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.642 0.258 . . . . 74.150000000000006 110.879 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.474 ' HA ' ' HB2' ' A' ' 96' ' ' ASP . 43.9 mt-10 -82.09 24.44 0.65 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.344 -0.389 . . . . 64.549999999999997 111.786 -175.433 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.405 HD21 ' HB1' ' A' ' 90' ' ' ALA . 94.2 mt -50.09 117.51 2.38 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 123.372 0.42 . . . . 71.310000000000002 111.83 -175.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.409 ' N ' ' HA ' ' A' ' 27' ' ' LEU . 79.2 mtt180 64.01 -78.47 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 O-C-N 124.048 0.842 . . . . 74.329999999999998 110.947 -172.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 8.9 p -138.52 134.67 34.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.277 -0.42 . . . . 71.310000000000002 110.157 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . 0.474 ' HB2' ' HA ' ' A' ' 92' ' ' GLU . 13.3 t70 -103.69 6.23 36.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.664 0.745 . . . . 75.510000000000005 109.533 179.481 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.435 ' CG ' HH21 ' A' ' 28' ' ' ARG . 35.8 m-20 . . . . . 0 C--O 1.248 0.981 0 CA-C-N 114.994 -1.003 . . . . 71.140000000000001 109.564 178.895 . . . . . . . . 1 1 . 1 stop_ save_